3-[(3,4-dichlorophenyl)methyl]-1-methyl-5-phenyl-1,3,4-benzotriazepin-2-one

Systemtic Name: 3-[(3,4-dichlorophenyl)methyl]-1-methyl-5-phenyl-1,3,4-benzotriazepin-2-one Openeye Name: 3-[(3,4-dichlorophenyl)methyl]-1-methyl-5-phenyl-1,3,4-benzotriazepin-2-one CAS Name: 3-[(3,4-dichlorophenyl)methyl]-1-methyl-5-phenyl-1,3,4-benzotriazepin-2-one IUPAC Name: 3-[(3,4-dichlorophenyl)methyl]-1-methyl-5-phenyl-1,3,4-benzotriazepin-2-one Traditional Name: 3-(3,4-dichlorobenzyl)-1-methyl-5-phenyl-1,3,4-benzotriazepin-2-one Formula: C22H17Cl2N3O MolecularWeight: 410.29588

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2C(=NN(C1=O)CC3=CC(=C(C=C3)Cl)Cl)C4=CC=CC=C4

Isomeric SMILES

CN1C2=CC=CC=C2C(=NN(C1=O)CC3=CC(=C(C=C3)Cl)Cl)C4=CC=CC=C4

InChI

InChI=1S/C22H17Cl2N3O/c1-26-20-10-6-5-9-17(20)21(16-7-3-2-4-8-16)25-27(22(26)28)14-15-11-12-18(23)19(24)13-15/h2-13H,14H2,1H3