1-(2-chlorophenyl)-N,N-dipropyl-isoquinoline-3-carboxamide

Systemtic Name: 1-(2-chlorophenyl)-N,N-dipropyl-isoquinoline-3-carboxamide Openeye Name: 1-(2-chlorophenyl)-N,N-dipropyl-isoquinoline-3-carboxamide CAS Name: 1-(2-chlorophenyl)-N,N-dipropyl-3-isoquinolinecarboxamide IUPAC Name: 1-(2-chlorophenyl)-N,N-dipropylisoquinoline-3-carboxamide Traditional Name: 1-(2-chlorophenyl)-N,N-dipropyl-isoquinoline-3-carboxamide Formula: C22H23ClN2O MolecularWeight: 364.885288

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CCC)C(=O)C1=CC2=CC=CC=C2C(=N1)C3=CC=CC=C3Cl

Isomeric SMILES

CCCN(CCC)[11C](=O)C1=C[11C]2=CC=CC=C2C(=N1)C3=CC=CC=C3Cl

InChI

InChI=1S/C22H23ClN2O/c1-3-13-25(14-4-2)22(26)20-15-16-9-5-6-10-17(16)21(24-20)18-11-7-8-12-19(18)23/h5-12,15H,3-4,13-14H2,1-2H3/i16-1,22-1