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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCCN(C1)C(=O)CN2C(=O)C3=NC4=CC=CC=C4C3=CN2

Isomeric SMILES

CCOC(=O)C1CCCN(C1)C(=O)CN2C(=O)C3=NC4=CC=CC=C4C3=CN2

InChI

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