N-butyl-1-[(3,4-dichlorophenyl)methyl]-6,7-dimethoxy-isoquinoline-3-carboxamide

Systemtic Name: N-butyl-1-[(3,4-dichlorophenyl)methyl]-6,7-dimethoxy-isoquinoline-3-carboxamide Openeye Name: N-butyl-1-[(3,4-dichlorophenyl)methyl]-6,7-dimethoxy-isoquinoline-3-carboxamide CAS Name: N-butyl-1-[(3,4-dichlorophenyl)methyl]-6,7-dimethoxy-3-isoquinolinecarboxamide IUPAC Name: N-butyl-1-[(3,4-dichlorophenyl)methyl]-6,7-dimethoxyisoquinoline-3-carboxamide Traditional Name: N-butyl-1-(3,4-dichlorobenzyl)-6,7-dimethoxy-isoquinoline-3-carboxamide Formula: C23H24Cl2N2O3 MolecularWeight: 447.35426

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)C1=CC2=CC(=C(C=C2C(=N1)CC3=CC(=C(C=C3)Cl)Cl)OC)OC

Isomeric SMILES

CCCCNC(=O)C1=CC2=CC(=C(C=C2C(=N1)CC3=CC(=C(C=C3)Cl)Cl)OC)OC

InChI

InChI=1S/C23H24Cl2N2O3/c1-4-5-8-26-23(28)20-11-15-12-21(29-2)22(30-3)13-16(15)19(27-20)10-14-6-7-17(24)18(25)9-14/h6-7,9,11-13H,4-5,8,10H2,1-3H3,(H,26,28)