methyl 4-(11-methylbenzo[b][1,4]benzodiazepin-6-yl)benzoate

Systemtic Name: methyl 4-(11-methylbenzo[b][1,4]benzodiazepin-6-yl)benzoate Openeye Name: methyl 4-(11-methylbenzo[b][1,4]benzodiazepin-6-yl)benzoate CAS Name: 4-(11-methyl-6-benzo[b][1,4]benzodiazepinyl)benzoic acid methyl ester IUPAC Name: methyl 4-(11-methylbenzo[b][1,4]benzodiazepin-6-yl)benzoate Traditional Name: 4-(11-methylbenzo[b][1,4]benzodiazepin-6-yl)benzoic acid methyl ester Formula: C22H18N2O2 MolecularWeight: 342.39052

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2C(=NC3=CC=CC=C31)C4=CC=C(C=C4)C(=O)OC

Isomeric SMILES

CN1C2=CC=CC=C2C(=NC3=CC=CC=C31)C4=CC=C(C=C4)C(=O)OC

InChI

InChI=1S/C22H18N2O2/c1-24-19-9-5-3-7-17(19)21(23-18-8-4-6-10-20(18)24)15-11-13-16(14-12-15)22(25)26-2/h3-14H,1-2H3