[(1S)-2-(7-ethyl-1H-indol-3-yl)-2-oxidanylidene-1-phenyl-ethyl] 4-(hydroxymethyl)benzoate

Systemtic Name: [(1S)-2-(7-ethyl-1H-indol-3-yl)-2-oxidanylidene-1-phenyl-ethyl] 4-(hydroxymethyl)benzoate Openeye Name: [(1S)-2-(7-ethyl-1H-indol-3-yl)-2-oxo-1-phenyl-ethyl] 4-(hydroxymethyl)benzoate CAS Name: 4-(hydroxymethyl)benzoic 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] 4-(hydroxymethyl)benzoate Traditional Name: 4-methylolbenzoic acid [(1S)-2-(7-ethyl-1H-indol-3-yl)-2-keto-1-phenyl-ethyl] ester Formula: C26H23NO4 MolecularWeight: 413.46512

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H23NO4/c1-2-18-9-6-10-21-22(15-27-23(18)21)24(29)25(19-7-4-3-5-8-19)31-26(30)20-13-11-17(16-28)12-14-20/h3-15,25,27-28H,2,16H2,1H3/t25-/m0/s1