5-[(2,5-dimethylphenyl)methyl]-3-(2-oxidanylidene-2-piperidin-1-yl-ethyl)pyridazino[4,5-b]indol-4-one

Systemtic Name: 5-[(2,5-dimethylphenyl)methyl]-3-(2-oxidanylidene-2-piperidin-1-yl-ethyl)pyridazino[4,5-b]indol-4-one Openeye Name: 5-[(2,5-dimethylphenyl)methyl]-3-[2-oxo-2-(1-piperidyl)ethyl]pyridazino[4,5-b]indol-4-one CAS Name: 5-[(2,5-dimethylphenyl)methyl]-3-[2-oxo-2-(1-piperidinyl)ethyl]-4-pyridazino[4,5-b]indolone IUPAC Name: 5-[(2,5-dimethylphenyl)methyl]-3-(2-oxo-2-piperidin-1-ylethyl)pyridazino[4,5-b]indol-4-one Traditional Name: 5-(2,5-dimethylbenzyl)-3-(2-keto-2-piperidino-ethyl)pyridazin[4,5-b]indol-4-one Formula: C26H28N4O2 MolecularWeight: 428.52612

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)CN2C3=CC=CC=C3C4=C2C(=O)N(N=C4)CC(=O)N5CCCCC5

Isomeric SMILES

CC1=CC(=C(C=C1)C)CN2C3=CC=CC=C3C4=C2C(=O)N(N=C4)CC(=O)N5CCCCC5

InChI

InChI=1S/C26H28N4O2/c1-18-10-11-19(2)20(14-18)16-29-23-9-5-4-8-21(23)22-15-27-30(26(32)25(22)29)17-24(31)28-12-6-3-7-13-28/h4-5,8-11,14-15H,3,6-7,12-13,16-17H2,1-2H3