(phenylmethyl) 5-azanyl-6-[2-butyl-2-(4-naphthalen-2-ylbutanoyl)hydrazinyl]-6-oxidanylidene-hexanoate hydrochloride

Systemtic Name: (phenylmethyl) 5-azanyl-6-[2-butyl-2-(4-naphthalen-2-ylbutanoyl)hydrazinyl]-6-oxidanylidene-hexanoate hydrochloride Openeye Name: benzyl 5-amino-6-[2-butyl-2-[4-(2-naphthyl)butanoyl]hydrazino]-6-oxo-hexanoate hydrochloride CAS Name: 5-amino-6-[2-butyl-2-[4-(2-naphthalenyl)-1-oxobutyl]hydrazinyl]-6-oxohexanoic acid (phenylmethyl) ester hydrochloride IUPAC Name: benzyl 5-amino-6-[2-butyl-2-(4-naphthalen-2-ylbutanoyl)hydrazinyl]-6-oxohexanoate hydrochloride Traditional Name: 5-amino-6-[N'-butyl-N'-[4-(2-naphthyl)butanoyl]hydrazino]-6-keto-hexanoic acid benzyl ester hydrochloride Formula: C31H40ClN3O4 MolecularWeight: 554.12

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(C(=O)CCCC1=CC2=CC=CC=C2C=C1)NC(=O)C(CCCC(=O)OCC3=CC=CC=C3)N.Cl

Isomeric SMILES

CCCCN(C(=O)CCCC1=CC2=CC=CC=C2C=C1)NC(=O)C(CCCC(=O)OCC3=CC=CC=C3)N.Cl

InChI

InChI=1S/C31H39N3O4.ClH/c1-2-3-21-34(29(35)17-9-13-24-19-20-26-14-7-8-15-27(26)22-24)33-31(37)28(32)16-10-18-30(36)38-23-25-11-5-4-6-12-25;/h4-8,11-12,14-15,19-20,22,28H,2-3,9-10,13,16-18,21,23,32H2,1H3,(H,33,37);1H