2-azanyl-3-(2-chlorophenyl)carbonyl-5,6-dimethyl-benzenecarbonitrile

Systemtic Name: 2-azanyl-3-(2-chlorophenyl)carbonyl-5,6-dimethyl-benzenecarbonitrile Openeye Name: 2-amino-3-(2-chlorobenzoyl)-5,6-dimethyl-benzonitrile CAS Name: 2-amino-3-[(2-chlorophenyl)-oxomethyl]-5,6-dimethylbenzonitrile IUPAC Name: 2-amino-3-(2-chlorobenzoyl)-5,6-dimethylbenzonitrile Traditional Name: 2-amino-3-(2-chlorobenzoyl)-5,6-dimethyl-benzonitrile Formula: C16H13ClN2O MolecularWeight: 284.74022

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C(=C1)C(=O)C2=CC=CC=C2Cl)N)C#N)C

Isomeric SMILES

CC1=C(C(=C(C(=C1)C(=O)C2=CC=CC=C2Cl)N)C#N)C

InChI

InChI=1S/C16H13ClN2O/c1-9-7-12(15(19)13(8-18)10(9)2)16(20)11-5-3-4-6-14(11)17/h3-7H,19H2,1-2H3