O1-ethyl O4-[2-(7-ethyl-1H-indol-3-yl)-2-oxidanylidene-ethyl] (E)-but-2-enedioate

Systemtic Name: O1-ethyl O4-[2-(7-ethyl-1H-indol-3-yl)-2-oxidanylidene-ethyl] (E)-but-2-enedioate Openeye Name: O1-ethyl O4-[2-(7-ethyl-1H-indol-3-yl)-2-oxo-ethyl] (E)-but-2-enedioate CAS Name: (E)-2-butenedioic acid O1-ethyl ester O4-[2-(7-ethyl-1H-indol-3-yl)-2-oxoethyl] ester IUPAC Name: 1-O-ethyl 4-O-[2-(7-ethyl-1H-indol-3-yl)-2-oxoethyl] (E)-but-2-enedioate Traditional Name: (E)-but-2-enedioic acid O1-ethyl ester O4-[2-(7-ethyl-1H-indol-3-yl)-2-keto-ethyl] ester Formula: C18H19NO5 MolecularWeight: 329.34716

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC2=C1NC=C2C(=O)COC(=O)C=CC(=O)OCC

Isomeric SMILES

CCC1=CC=CC2=C1NC=C2C(=O)COC(=O)/C=C/C(=O)OCC

InChI

InChI=1S/C18H19NO5/c1-3-12-6-5-7-13-14(10-19-18(12)13)15(20)11-24-17(22)9-8-16(21)23-4-2/h5-10,19H,3-4,11H2,1-2H3/b9-8+