O1-ethyl O4-[(1R)-2-(1H-indol-3-yl)-2-oxidanylidene-1-phenyl-ethyl] (E)-but-2-enedioate

Systemtic Name: O1-ethyl O4-[(1R)-2-(1H-indol-3-yl)-2-oxidanylidene-1-phenyl-ethyl] (E)-but-2-enedioate Openeye Name: O1-ethyl O4-[(1R)-2-(1H-indol-3-yl)-2-oxo-1-phenyl-ethyl] (E)-but-2-enedioate CAS Name: (E)-2-butenedioic acid O1-ethyl ester O4-[(1R)-2-(1H-indol-3-yl)-2-oxo-1-phenylethyl] ester IUPAC Name: 1-O-ethyl 4-O-[(1R)-2-(1H-indol-3-yl)-2-oxo-1-phenylethyl] (E)-but-2-enedioate Traditional Name: (E)-but-2-enedioic acid O1-ethyl ester O4-[(1R)-2-(1H-indol-3-yl)-2-keto-1-phenyl-ethyl] ester Formula: C22H19NO5 MolecularWeight: 377.38996

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C=CC(=O)OC(C1=CC=CC=C1)C(=O)C2=CNC3=CC=CC=C32

Isomeric SMILES

CCOC(=O)/C=C/C(=O)O[C@H](C1=CC=CC=C1)C(=O)C2=CNC3=CC=CC=C32

InChI

InChI=1S/C22H19NO5/c1-2-27-19(24)12-13-20(25)28-22(15-8-4-3-5-9-15)21(26)17-14-23-18-11-7-6-10-16(17)18/h3-14,22-23H,2H2,1H3/b13-12+/t22-/m1/s1