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

Systemtic Name: methyl 4-[(phenylmethyl)carbamoyl]-5H-pyridazino[4,5-b]indole-1-carboxylate Openeye Name: methyl 4-(benzylcarbamoyl)-5H-pyridazino[4,5-b]indole-1-carboxylate CAS Name: 4-[oxo-[(phenylmethyl)amino]methyl]-5H-pyridazino[4,5-b]indole-1-carboxylic acid methyl ester IUPAC Name: methyl 4-(benzylcarbamoyl)-5H-pyridazino[4,5-b]indole-1-carboxylate Traditional Name: 4-(benzylcarbamoyl)-5H-pyridazin[4,5-b]indole-1-carboxylic acid methyl ester Formula: C20H16N4O3 MolecularWeight: 360.36604

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=NN=C(C2=C1C3=CC=CC=C3N2)C(=O)NCC4=CC=CC=C4

Isomeric SMILES

COC(=O)C1=NN=C(C2=C1C3=CC=CC=C3N2)C(=O)NCC4=CC=CC=C4

InChI

InChI=1S/C20H16N4O3/c1-27-20(26)17-15-13-9-5-6-10-14(13)22-16(15)18(24-23-17)19(25)21-11-12-7-3-2-4-8-12/h2-10,22H,11H2,1H3,(H,21,25)