6-azanyl-8-(3-chlorophenyl)-2-methyl-3,4-dihydro-1H-isoquinoline-5,7-dicarbonitrile

Systemtic Name: 6-azanyl-8-(3-chlorophenyl)-2-methyl-3,4-dihydro-1H-isoquinoline-5,7-dicarbonitrile Openeye Name: 6-amino-8-(3-chlorophenyl)-2-methyl-3,4-dihydro-1H-isoquinoline-5,7-dicarbonitrile CAS Name: 6-amino-8-(3-chlorophenyl)-2-methyl-3,4-dihydro-1H-isoquinoline-5,7-dicarbonitrile IUPAC Name: 6-amino-8-(3-chlorophenyl)-2-methyl-3,4-dihydro-1H-isoquinoline-5,7-dicarbonitrile Traditional Name: 6-amino-8-(3-chlorophenyl)-2-methyl-3,4-dihydro-1H-isoquinoline-5,7-dicarbonitrile Formula: C18H15ClN4 MolecularWeight: 322.7915

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCC2=C(C1)C(=C(C(=C2C#N)N)C#N)C3=CC(=CC=C3)Cl

Isomeric SMILES

CN1CCC2=C(C1)C(=C(C(=C2C#N)N)C#N)C3=CC(=CC=C3)Cl

InChI

InChI=1S/C18H15ClN4/c1-23-6-5-13-14(8-20)18(22)15(9-21)17(16(13)10-23)11-3-2-4-12(19)7-11/h2-4,7H,5-6,10,22H2,1H3