3-(2-methylpentanoylamino)-2-oxidanylidene-N-(phenylmethyl)octanamide

Systemtic Name: 3-(2-methylpentanoylamino)-2-oxidanylidene-N-(phenylmethyl)octanamide Openeye Name: N-benzyl-3-(2-methylpentanoylamino)-2-oxo-octanamide CAS Name: 3-[(2-methyl-1-oxopentyl)amino]-2-oxo-N-(phenylmethyl)octanamide IUPAC Name: N-benzyl-3-(2-methylpentanoylamino)-2-oxooctanamide Traditional Name: N-benzyl-2-keto-3-(2-methylpentanoylamino)caprylamide Formula: C21H32N2O3 MolecularWeight: 360.49038

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C(=O)C(=O)NCC1=CC=CC=C1)NC(=O)C(C)CCC

Isomeric SMILES

CCCCCC(C(=O)C(=O)NCC1=CC=CC=C1)NC(=O)C(C)CCC

InChI

InChI=1S/C21H32N2O3/c1-4-6-8-14-18(23-20(25)16(3)11-5-2)19(24)21(26)22-15-17-12-9-7-10-13-17/h7,9-10,12-13,16,18H,4-6,8,11,14-15H2,1-3H3,(H,22,26)(H,23,25)