methyl 2-[5-[(2-methylphenyl)methyl]-4-oxidanylidene-pyridazino[4,5-b]indol-3-yl]ethanoate

Systemtic Name: methyl 2-[5-[(2-methylphenyl)methyl]-4-oxidanylidene-pyridazino[4,5-b]indol-3-yl]ethanoate Openeye Name: methyl 2-[5-(o-tolylmethyl)-4-oxo-pyridazino[4,5-b]indol-3-yl]acetate CAS Name: 2-[5-[(2-methylphenyl)methyl]-4-oxo-3-pyridazino[4,5-b]indolyl]acetic acid methyl ester IUPAC Name: methyl 2-[5-[(2-methylphenyl)methyl]-4-oxopyridazino[4,5-b]indol-3-yl]acetate Traditional Name: 2-[4-keto-5-(2-methylbenzyl)pyridazin[4,5-b]indol-3-yl]acetic acid methyl ester Formula: C21H19N3O3 MolecularWeight: 361.39386

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CN2C3=CC=CC=C3C4=C2C(=O)N(N=C4)CC(=O)OC

Isomeric SMILES

CC1=CC=CC=C1CN2C3=CC=CC=C3C4=C2C(=O)N(N=C4)CC(=O)OC

InChI

InChI=1S/C21H19N3O3/c1-14-7-3-4-8-15(14)12-23-18-10-6-5-9-16(18)17-11-22-24(13-19(25)27-2)21(26)20(17)23/h3-11H,12-13H2,1-2H3