1-(cyanomethyl)-N-(2,4-dichlorophenyl)-3,4-dihydro-1H-isoquinoline-2-carboxamide

Systemtic Name: 1-(cyanomethyl)-N-(2,4-dichlorophenyl)-3,4-dihydro-1H-isoquinoline-2-carboxamide Openeye Name: 1-(cyanomethyl)-N-(2,4-dichlorophenyl)-3,4-dihydro-1H-isoquinoline-2-carboxamide CAS Name: 1-(cyanomethyl)-N-(2,4-dichlorophenyl)-3,4-dihydro-1H-isoquinoline-2-carboxamide IUPAC Name: 1-(cyanomethyl)-N-(2,4-dichlorophenyl)-3,4-dihydro-1H-isoquinoline-2-carboxamide Traditional Name: 1-(cyanomethyl)-N-(2,4-dichlorophenyl)-3,4-dihydro-1H-isoquinoline-2-carboxamide Formula: C18H15Cl2N3O MolecularWeight: 360.2372

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(C2=CC=CC=C21)CC#N)C(=O)NC3=C(C=C(C=C3)Cl)Cl

Isomeric SMILES

C1CN(C(C2=CC=CC=C21)CC#N)C(=O)NC3=C(C=C(C=C3)Cl)Cl

InChI

InChI=1S/C18H15Cl2N3O/c19-13-5-6-16(15(20)11-13)22-18(24)23-10-8-12-3-1-2-4-14(12)17(23)7-9-21/h1-6,11,17H,7-8,10H2,(H,22,24)