methyl 9-methyl-4-phenyl-3,5-dihydro-1,3,4-benzotriazepine-2-carboxylate

Systemtic Name: methyl 9-methyl-4-phenyl-3,5-dihydro-1,3,4-benzotriazepine-2-carboxylate Openeye Name: methyl 9-methyl-4-phenyl-3,5-dihydro-1,3,4-benzotriazepine-2-carboxylate CAS Name: 9-methyl-4-phenyl-3,5-dihydro-1,3,4-benzotriazepine-2-carboxylic acid methyl ester IUPAC Name: methyl 9-methyl-4-phenyl-3,5-dihydro-1,3,4-benzotriazepine-2-carboxylate Traditional Name: 9-methyl-4-phenyl-3,5-dihydro-1,3,4-benzotriazepine-2-carboxylic acid methyl ester Formula: C17H17N3O2 MolecularWeight: 295.33578

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=C1N=C(NN(C2)C3=CC=CC=C3)C(=O)OC

Isomeric SMILES

CC1=CC=CC2=C1N=C(NN(C2)C3=CC=CC=C3)C(=O)OC

InChI

InChI=1S/C17H17N3O2/c1-12-7-6-8-13-11-20(14-9-4-3-5-10-14)19-16(17(21)22-2)18-15(12)13/h3-10H,11H2,1-2H3,(H,18,19)