7-azanyl-3-(2-methylpentanoylamino)-2-oxidanylidene-N-(phenylmethyl)heptanamide

Systemtic Name: 7-azanyl-3-(2-methylpentanoylamino)-2-oxidanylidene-N-(phenylmethyl)heptanamide Openeye Name: 7-amino-N-benzyl-3-(2-methylpentanoylamino)-2-oxo-heptanamide CAS Name: 7-amino-3-[(2-methyl-1-oxopentyl)amino]-2-oxo-N-(phenylmethyl)heptanamide IUPAC Name: 7-amino-N-benzyl-3-(2-methylpentanoylamino)-2-oxoheptanamide Traditional Name: 7-amino-N-benzyl-2-keto-3-(2-methylpentanoylamino)enanthamide Formula: C20H31N3O3 MolecularWeight: 361.47844

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C)C(=O)NC(CCCCN)C(=O)C(=O)NCC1=CC=CC=C1

Isomeric SMILES

CCCC(C)C(=O)NC(CCCCN)C(=O)C(=O)NCC1=CC=CC=C1

InChI

InChI=1S/C20H31N3O3/c1-3-9-15(2)19(25)23-17(12-7-8-13-21)18(24)20(26)22-14-16-10-5-4-6-11-16/h4-6,10-11,15,17H,3,7-9,12-14,21H2,1-2H3,(H,22,26)(H,23,25)