ethyl 1-[2-(4-oxidanylidene-5H-pyrimido[5,4-b]indol-3-yl)ethanoyl]piperidine-4-carboxylate

Systemtic Name: ethyl 1-[2-(4-oxidanylidene-5H-pyrimido[5,4-b]indol-3-yl)ethanoyl]piperidine-4-carboxylate Openeye Name: ethyl 1-[2-(4-oxo-5H-pyrimido[5,4-b]indol-3-yl)acetyl]piperidine-4-carboxylate CAS Name: 1-[1-oxo-2-(4-oxo-5H-pyrimido[5,4-b]indol-3-yl)ethyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[2-(4-oxo-5H-pyrimido[5,4-b]indol-3-yl)acetyl]piperidine-4-carboxylate Traditional Name: 1-[2-(4-keto-5H-pyrimid[5,4-b]indol-3-yl)acetyl]isonipecotic acid ethyl ester Formula: C20H22N4O4 MolecularWeight: 382.41308

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCN(CC1)C(=O)CN2C=NC3=C(C2=O)NC4=CC=CC=C43

Isomeric SMILES

CCOC(=O)C1CCN(CC1)C(=O)CN2C=NC3=C(C2=O)NC4=CC=CC=C43

InChI

InChI=1S/C20H22N4O4/c1-2-28-20(27)13-7-9-23(10-8-13)16(25)11-24-12-21-17-14-5-3-4-6-15(14)22-18(17)19(24)26/h3-6,12-13,22H,2,7-11H2,1H3