methyl 2-[2-(8-methyl-4-oxidanylidene-2H-pyridazino[4,5-b]indol-3-yl)ethanoylamino]benzoate

Systemtic Name: methyl 2-[2-(8-methyl-4-oxidanylidene-2H-pyridazino[4,5-b]indol-3-yl)ethanoylamino]benzoate Openeye Name: methyl 2-[[2-(8-methyl-4-oxo-2H-pyridazino[4,5-b]indol-3-yl)acetyl]amino]benzoate CAS Name: 2-[[2-(8-methyl-4-oxo-2H-pyridazino[4,5-b]indol-3-yl)-1-oxoethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 2-[[2-(8-methyl-4-oxo-2H-pyridazino[4,5-b]indol-3-yl)acetyl]amino]benzoate Traditional Name: 2-[[2-(4-keto-8-methyl-2H-pyridazin[4,5-b]indol-3-yl)acetyl]amino]benzoic acid methyl ester Formula: C21H18N4O4 MolecularWeight: 390.39202

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C3C2=CNN(C3=O)CC(=O)NC4=CC=CC=C4C(=O)OC

Isomeric SMILES

CC1=CC2=C(C=C1)N=C3C2=CNN(C3=O)CC(=O)NC4=CC=CC=C4C(=O)OC

InChI

InChI=1S/C21H18N4O4/c1-12-7-8-17-14(9-12)15-10-22-25(20(27)19(15)24-17)11-18(26)23-16-6-4-3-5-13(16)21(28)29-2/h3-10,22H,11H2,1-2H3,(H,23,26)