InChI=1S/C22H26N2O3.ClH/c1-15(2)20(23)21(25)24-13-18-11-7-6-10-17(18)12-19(24)22(26)27-14-16-8-4-3-5-9-16;/h3-11,15,19-20H,12-14,23H2,1-2H3;1H/t19-,20-;/m0./s1

【InChIKey】

InChIKey=WQZKTGMHLDJLKO-FKLPMGAJSA-N

【SMILES】

CC(C)[C@@H](C(=O)N1Cc2ccccc2C[C@H]1C(=O)OCc3ccccc3)N.Cl

【MOL File】

L-N-VALYL-L-1,2,3,4-….mol

2Chemical and Physical Properties

【Computed Properties】

H bond donor:1

H bond acceptor:5

XLogP3:3.0

Bulk/Fine:FB

3Material Safety Data Sheet(MSDS)

4CML File

L-N-VALYL-L-1,2,3,4-TETRAHYDROISOQUINOLINE-3-CARBOXYLIC ACID BENZYL ESTER HYDROCHLORIDE.cml

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172499-31-9 L-N-VALYL-L-1,2,3,4-TETRAHYDROISOQUINOLINE-3-CARBOXYLIC ACID BENZYL ESTER HYDROCHLORIDE

1Identification

【Name】

【CAS】

【MDL】

【English Synonyms】

【Formula】

【MolWeight】

【Inchi】