3-(3-chloranyl-4-methoxy-phenyl)-5-methyl-1-(2-methylpiperidin-1-yl)carbonyl-pyridazino[4,5-b]indol-4-one

Systemtic Name: 3-(3-chloranyl-4-methoxy-phenyl)-5-methyl-1-(2-methylpiperidin-1-yl)carbonyl-pyridazino[4,5-b]indol-4-one Openeye Name: 3-(3-chloro-4-methoxy-phenyl)-5-methyl-1-(2-methylpiperidine-1-carbonyl)pyridazino[4,5-b]indol-4-one CAS Name: 3-(3-chloro-4-methoxyphenyl)-5-methyl-1-[(2-methyl-1-piperidinyl)-oxomethyl]-4-pyridazino[4,5-b]indolone IUPAC Name: 3-(3-chloro-4-methoxyphenyl)-5-methyl-1-(2-methylpiperidine-1-carbonyl)pyridazino[4,5-b]indol-4-one Traditional Name: 3-(3-chloro-4-methoxy-phenyl)-5-methyl-1-(2-methylpiperidine-1-carbonyl)pyridazin[4,5-b]indol-4-one Formula: C25H25ClN4O3 MolecularWeight: 464.944

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCN1C(=O)C2=NN(C(=O)C3=C2C4=CC=CC=C4N3C)C5=CC(=C(C=C5)OC)Cl

Isomeric SMILES

CC1CCCCN1C(=O)C2=NN(C(=O)C3=C2C4=CC=CC=C4N3C)C5=CC(=C(C=C5)OC)Cl

InChI

InChI=1S/C25H25ClN4O3/c1-15-8-6-7-13-29(15)24(31)22-21-17-9-4-5-10-19(17)28(2)23(21)25(32)30(27-22)16-11-12-20(33-3)18(26)14-16/h4-5,9-12,14-15H,6-8,13H2,1-3H3