(phenylmethyl) 9H-pyridazino[3,4-b]indole-3-carboxylate

Systemtic Name: (phenylmethyl) 9H-pyridazino[3,4-b]indole-3-carboxylate Openeye Name: benzyl 9H-pyridazino[3,4-b]indole-3-carboxylate CAS Name: 9H-pyridazino[3,4-b]indole-3-carboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 9H-pyridazino[3,4-b]indole-3-carboxylate Traditional Name: 9H-pyridazin[3,4-b]indole-3-carboxylic acid benzyl ester Formula: C18H13N3O2 MolecularWeight: 303.31472

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)C2=NN=C3C(=C2)C4=CC=CC=C4N3

Isomeric SMILES

C1=CC=C(C=C1)COC(=O)C2=NN=C3C(=C2)C4=CC=CC=C4N3

InChI

InChI=1S/C18H13N3O2/c22-18(23-11-12-6-2-1-3-7-12)16-10-14-13-8-4-5-9-15(13)19-17(14)21-20-16/h1-10H,11H2,(H,19,21)