[(1S)-2-(7-ethyl-1H-indol-3-yl)-2-oxidanylidene-1-phenyl-ethyl] 2-(3,4-dimethylphenyl)ethanoate

Systemtic Name: [(1S)-2-(7-ethyl-1H-indol-3-yl)-2-oxidanylidene-1-phenyl-ethyl] 2-(3,4-dimethylphenyl)ethanoate Openeye Name: [(1S)-2-(7-ethyl-1H-indol-3-yl)-2-oxo-1-phenyl-ethyl] 2-(3,4-dimethylphenyl)acetate CAS Name: 2-(3,4-dimethylphenyl)acetic acid [(1S)-2-(7-ethyl-1H-indol-3-yl)-2-oxo-1-phenylethyl] ester IUPAC Name: [(1S)-2-(7-ethyl-1H-indol-3-yl)-2-oxo-1-phenylethyl] 2-(3,4-dimethylphenyl)acetate Traditional Name: 2-(3,4-dimethylphenyl)acetic acid [(1S)-2-(7-ethyl-1H-indol-3-yl)-2-keto-1-phenyl-ethyl] ester Formula: C28H27NO3 MolecularWeight: 425.51888

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC2=C1NC=C2C(=O)C(C3=CC=CC=C3)OC(=O)CC4=CC(=C(C=C4)C)C

Isomeric SMILES

CCC1=CC=CC2=C1NC=C2C(=O)[C@H](C3=CC=CC=C3)OC(=O)CC4=CC(=C(C=C4)C)C

InChI

InChI=1S/C28H27NO3/c1-4-21-11-8-12-23-24(17-29-26(21)23)27(31)28(22-9-6-5-7-10-22)32-25(30)16-20-14-13-18(2)19(3)15-20/h5-15,17,28-29H,4,16H2,1-3H3/t28-/m0/s1