methyl 4-[methyl-(phenylmethyl)carbamoyl]-5H-pyridazino[4,5-b]indole-1-carboxylate

Systemtic Name: methyl 4-[methyl-(phenylmethyl)carbamoyl]-5H-pyridazino[4,5-b]indole-1-carboxylate Openeye Name: methyl 4-[benzyl(methyl)carbamoyl]-5H-pyridazino[4,5-b]indole-1-carboxylate CAS Name: 4-[[methyl-(phenylmethyl)amino]-oxomethyl]-5H-pyridazino[4,5-b]indole-1-carboxylic acid methyl ester IUPAC Name: methyl 4-[benzyl(methyl)carbamoyl]-5H-pyridazino[4,5-b]indole-1-carboxylate Traditional Name: 4-[benzyl(methyl)carbamoyl]-5H-pyridazin[4,5-b]indole-1-carboxylic acid methyl ester Formula: C21H18N4O3 MolecularWeight: 374.39262

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=CC=C1)C(=O)C2=NN=C(C3=C2NC4=CC=CC=C43)C(=O)OC

Isomeric SMILES

CN(CC1=CC=CC=C1)C(=O)C2=NN=C(C3=C2NC4=CC=CC=C43)C(=O)OC

InChI

InChI=1S/C21H18N4O3/c1-25(12-13-8-4-3-5-9-13)20(26)19-17-16(18(23-24-19)21(27)28-2)14-10-6-7-11-15(14)22-17/h3-11,22H,12H2,1-2H3