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

Systemtic Name: ethyl 1-[2-[(1R)-1-(1H-indol-3-yl)-3-oxidanylidene-1H-isoindol-2-yl]ethanoyl]piperidine-4-carboxylate Openeye Name: ethyl 1-[2-[(1R)-1-(1H-indol-3-yl)-3-oxo-isoindolin-2-yl]acetyl]piperidine-4-carboxylate CAS Name: 1-[2-[(1R)-1-(1H-indol-3-yl)-3-oxo-1H-isoindol-2-yl]-1-oxoethyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[2-[(1R)-1-(1H-indol-3-yl)-3-oxo-1H-isoindol-2-yl]acetyl]piperidine-4-carboxylate Traditional Name: 1-[2-[(1R)-1-(1H-indol-3-yl)-3-keto-isoindolin-2-yl]acetyl]isonipecotic acid ethyl ester Formula: C26H27N3O4 MolecularWeight: 445.51028

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCN(CC1)C(=O)CN2C(C3=CC=CC=C3C2=O)C4=CNC5=CC=CC=C54

Isomeric SMILES

CCOC(=O)C1CCN(CC1)C(=O)CN2[C@H](C3=CC=CC=C3C2=O)C4=CNC5=CC=CC=C54

InChI

InChI=1S/C26H27N3O4/c1-2-33-26(32)17-11-13-28(14-12-17)23(30)16-29-24(19-8-3-4-9-20(19)25(29)31)21-15-27-22-10-6-5-7-18(21)22/h3-10,15,17,24,27H,2,11-14,16H2,1H3/t24-/m1/s1