ethyl 1-[2-(8-methyl-4-oxidanylidene-2H-pyridazino[4,5-b]indol-3-yl)ethanoyl]piperidine-3-carboxylate

Systemtic Name: ethyl 1-[2-(8-methyl-4-oxidanylidene-2H-pyridazino[4,5-b]indol-3-yl)ethanoyl]piperidine-3-carboxylate Openeye Name: ethyl 1-[2-(8-methyl-4-oxo-2H-pyridazino[4,5-b]indol-3-yl)acetyl]piperidine-3-carboxylate CAS Name: 1-[2-(8-methyl-4-oxo-2H-pyridazino[4,5-b]indol-3-yl)-1-oxoethyl]-3-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[2-(8-methyl-4-oxo-2H-pyridazino[4,5-b]indol-3-yl)acetyl]piperidine-3-carboxylate Traditional Name: 1-[2-(4-keto-8-methyl-2H-pyridazin[4,5-b]indol-3-yl)acetyl]nipecotic acid ethyl ester Formula: C21H24N4O4 MolecularWeight: 396.43966

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCCN(C1)C(=O)CN2C(=O)C3=NC4=C(C3=CN2)C=C(C=C4)C

Isomeric SMILES

CCOC(=O)C1CCCN(C1)C(=O)CN2C(=O)C3=NC4=C(C3=CN2)C=C(C=C4)C

InChI

InChI=1S/C21H24N4O4/c1-3-29-21(28)14-5-4-8-24(11-14)18(26)12-25-20(27)19-16(10-22-25)15-9-13(2)6-7-17(15)23-19/h6-7,9-10,14,22H,3-5,8,11-12H2,1-2H3