[4-[2-[4-oxidanylidene-4-(1-phenylethylamino)butanoyl]oxyethanoyl]phenyl] 4-methylbenzoate

Systemtic Name: [4-[2-[4-oxidanylidene-4-(1-phenylethylamino)butanoyl]oxyethanoyl]phenyl] 4-methylbenzoate Openeye Name: [4-[2-[4-oxo-4-(1-phenylethylamino)butanoyl]oxyacetyl]phenyl] 4-methylbenzoate CAS Name: 4-methylbenzoic acid [4-[2-[1,4-dioxo-4-(1-phenylethylamino)butoxy]-1-oxoethyl]phenyl] ester IUPAC Name: [4-[2-[4-oxo-4-(1-phenylethylamino)butanoyl]oxyacetyl]phenyl] 4-methylbenzoate Traditional Name: 4-methylbenzoic acid [4-[2-[4-keto-4-(1-phenylethylamino)butanoyl]oxyacetyl]phenyl] ester Formula: C28H27NO6 MolecularWeight: 473.51708

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)OC2=CC=C(C=C2)C(=O)COC(=O)CCC(=O)NC(C)C3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)OC2=CC=C(C=C2)C(=O)COC(=O)CCC(=O)NC(C)C3=CC=CC=C3

InChI

InChI=1S/C28H27NO6/c1-19-8-10-23(11-9-19)28(33)35-24-14-12-22(13-15-24)25(30)18-34-27(32)17-16-26(31)29-20(2)21-6-4-3-5-7-21/h3-15,20H,16-18H2,1-2H3,(H,29,31)