[2-(1H-indol-3-yl)-2-oxidanylidene-1-phenyl-ethyl] 4-butoxybenzoate

Systemtic Name: [2-(1H-indol-3-yl)-2-oxidanylidene-1-phenyl-ethyl] 4-butoxybenzoate Openeye Name: [2-(1H-indol-3-yl)-2-oxo-1-phenyl-ethyl] 4-butoxybenzoate CAS Name: 4-butoxybenzoic acid [2-(1H-indol-3-yl)-2-oxo-1-phenylethyl] ester IUPAC Name: [2-(1H-indol-3-yl)-2-oxo-1-phenylethyl] 4-butoxybenzoate Traditional Name: 4-butoxybenzoic acid [2-(1H-indol-3-yl)-2-keto-1-phenyl-ethyl] ester Formula: C27H25NO4 MolecularWeight: 427.4917

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C(=O)OC(C2=CC=CC=C2)C(=O)C3=CNC4=CC=CC=C43

Isomeric SMILES

CCCCOC1=CC=C(C=C1)C(=O)OC(C2=CC=CC=C2)C(=O)C3=CNC4=CC=CC=C43

InChI

InChI=1S/C27H25NO4/c1-2-3-17-31-21-15-13-20(14-16-21)27(30)32-26(19-9-5-4-6-10-19)25(29)23-18-28-24-12-8-7-11-22(23)24/h4-16,18,26,28H,2-3,17H2,1H3