[2-[(4-butylphenyl)amino]-2-oxidanylidene-ethyl] 2-phenethylbenzoate

Systemtic Name: [2-[(4-butylphenyl)amino]-2-oxidanylidene-ethyl] 2-phenethylbenzoate Openeye Name: [2-(4-butylanilino)-2-oxo-ethyl] 2-phenethylbenzoate CAS Name: 2-phenethylbenzoic acid [2-(4-butylanilino)-2-oxoethyl] ester IUPAC Name: [2-(4-butylanilino)-2-oxoethyl] 2-phenethylbenzoate Traditional Name: 2-phenethylbenzoic acid [2-(4-butylanilino)-2-keto-ethyl] ester Formula: C27H29NO3 MolecularWeight: 415.52406

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)NC(=O)COC(=O)C2=CC=CC=C2CCC3=CC=CC=C3

Isomeric SMILES

CCCCC1=CC=C(C=C1)NC(=O)COC(=O)C2=CC=CC=C2CCC3=CC=CC=C3

InChI

InChI=1S/C27H29NO3/c1-2-3-9-22-15-18-24(19-16-22)28-26(29)20-31-27(30)25-13-8-7-12-23(25)17-14-21-10-5-4-6-11-21/h4-8,10-13,15-16,18-19H,2-3,9,14,17,20H2,1H3,(H,28,29)