ethyl 1-[2-[1-(1-methylindol-3-yl)-3-oxidanylidene-1H-isoindol-2-yl]ethanoyl]piperidine-4-carboxylate

Systemtic Name: ethyl 1-[2-[1-(1-methylindol-3-yl)-3-oxidanylidene-1H-isoindol-2-yl]ethanoyl]piperidine-4-carboxylate Openeye Name: ethyl 1-[2-[1-(1-methylindol-3-yl)-3-oxo-isoindolin-2-yl]acetyl]piperidine-4-carboxylate CAS Name: 1-[2-[1-(1-methyl-3-indolyl)-3-oxo-1H-isoindol-2-yl]-1-oxoethyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[2-[1-(1-methylindol-3-yl)-3-oxo-1H-isoindol-2-yl]acetyl]piperidine-4-carboxylate Traditional Name: 1-[2-[1-keto-3-(1-methylindol-3-yl)isoindolin-2-yl]acetyl]isonipecotic acid ethyl ester Formula: C27H29N3O4 MolecularWeight: 459.53686

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCN(CC1)C(=O)CN2C(C3=CC=CC=C3C2=O)C4=CN(C5=CC=CC=C54)C

Isomeric SMILES

CCOC(=O)C1CCN(CC1)C(=O)CN2C(C3=CC=CC=C3C2=O)C4=CN(C5=CC=CC=C54)C

InChI

InChI=1S/C27H29N3O4/c1-3-34-27(33)18-12-14-29(15-13-18)24(31)17-30-25(20-9-4-5-10-21(20)26(30)32)22-16-28(2)23-11-7-6-8-19(22)23/h4-11,16,18,25H,3,12-15,17H2,1-2H3