Molecular Structure:
CCD No.:CCD00322846
ETHYL 3-(3-FORMYL-2,5-DIMETHYL-1H-PYRROL-1-YL)BENZOATE
CAS No.:
356087-76-8
Formula:C16 H17 N O3
MolWeight:271.314
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| Product Name： | ETHYL 3-(3-FORMYL-2,5-DIMETHYL-1H-PYRROL-1-YL)BENZOATE |
| CAS： | 356087-76-8 |
| English Synonyms： | BENZOIC ACID, 3-(3-FORMYL-2,5-DIMETHYL-1H-PYRROL-1-YL)-, ETHYL ESTER ; ETHYL 3-(3-FORMYL-2,5-DIMETHYL-1H-PYRROL-1-YL)BENZOATE ; 3-(3-FORMYL-2,5-DIMETHYL-1H-PYRROL-1-YL)-BENZOIC ACID ETHYL ESTER |
| MDL Number.： | MFCD02603521 |
| H bond acceptor： | 4 |
| H bond donor： | 0 |
| Smile： | CCOC(=O)c1cccc(c1)n2c(cc(c2C)C=O)C |
| InChi： | InChI=1S/C16H17NO3/c1-4-20-16(19)13-6-5-7-15(9-13)17-11(2)8-14(10-18)12(17)3/h5-10H,4H2,1-3H3 |
| InChiKey： | InChIKey=BIIKXXGHWXUQPQ-UHFFFAOYSA-N |
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