phenacyl 2-[(4-chlorophenyl)carbonylamino]-4-methyl-pentanoate

Systemtic Name: phenacyl 2-[(4-chlorophenyl)carbonylamino]-4-methyl-pentanoate Openeye Name: phenacyl 2-[(4-chlorobenzoyl)amino]-4-methyl-pentanoate CAS Name: 2-[[(4-chlorophenyl)-oxomethyl]amino]-4-methylpentanoic acid phenacyl ester IUPAC Name: phenacyl 2-[(4-chlorobenzoyl)amino]-4-methylpentanoate Traditional Name: 2-[(4-chlorobenzoyl)amino]-4-methyl-valeric acid phenacyl ester Formula: C21H22ClNO4 MolecularWeight: 387.85668

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)OCC(=O)C1=CC=CC=C1)NC(=O)C2=CC=C(C=C2)Cl

Isomeric SMILES

CC(C)CC(C(=O)OCC(=O)C1=CC=CC=C1)NC(=O)C2=CC=C(C=C2)Cl

InChI

InChI=1S/C21H22ClNO4/c1-14(2)12-18(23-20(25)16-8-10-17(22)11-9-16)21(26)27-13-19(24)15-6-4-3-5-7-15/h3-11,14,18H,12-13H2,1-2H3,(H,23,25)