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

Systemtic Name: O1-ethyl O4-[(2R)-1-(2-methyl-1H-indol-3-yl)-1-oxidanylidene-propan-2-yl] (E)-but-2-enedioate Openeye Name: O1-ethyl O4-[(1R)-1-methyl-2-(2-methyl-1H-indol-3-yl)-2-oxo-ethyl] (E)-but-2-enedioate CAS Name: (E)-2-butenedioic acid O1-ethyl ester O4-[(2R)-1-(2-methyl-1H-indol-3-yl)-1-oxopropan-2-yl] ester IUPAC Name: 1-O-ethyl 4-O-[(2R)-1-(2-methyl-1H-indol-3-yl)-1-oxopropan-2-yl] (E)-but-2-enedioate Traditional Name: (E)-but-2-enedioic acid O1-ethyl ester O4-[(1R)-2-keto-1-methyl-2-(2-methyl-1H-indol-3-yl)ethyl] ester Formula: C18H19NO5 MolecularWeight: 329.34716

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C=CC(=O)OC(C)C(=O)C1=C(NC2=CC=CC=C21)C

Isomeric SMILES

CCOC(=O)/C=C/C(=O)O[C@H](C)C(=O)C1=C(NC2=CC=CC=C21)C

InChI

InChI=1S/C18H19NO5/c1-4-23-15(20)9-10-16(21)24-12(3)18(22)17-11(2)19-14-8-6-5-7-13(14)17/h5-10,12,19H,4H2,1-3H3/b10-9+/t12-/m1/s1