N-[3-[(3,4-dichlorophenyl)methylamino]-3-oxidanylidene-propyl]-6,7-dimethoxy-3,4-dihydro-1H-isoquinoline-2-carboxamide

Systemtic Name: N-[3-[(3,4-dichlorophenyl)methylamino]-3-oxidanylidene-propyl]-6,7-dimethoxy-3,4-dihydro-1H-isoquinoline-2-carboxamide Openeye Name: N-[3-[(3,4-dichlorophenyl)methylamino]-3-oxo-propyl]-6,7-dimethoxy-3,4-dihydro-1H-isoquinoline-2-carboxamide CAS Name: N-[3-[(3,4-dichlorophenyl)methylamino]-3-oxopropyl]-6,7-dimethoxy-3,4-dihydro-1H-isoquinoline-2-carboxamide IUPAC Name: N-[3-[(3,4-dichlorophenyl)methylamino]-3-oxopropyl]-6,7-dimethoxy-3,4-dihydro-1H-isoquinoline-2-carboxamide Traditional Name: N-[3-[(3,4-dichlorobenzyl)amino]-3-keto-propyl]-6,7-dimethoxy-3,4-dihydro-1H-isoquinoline-2-carboxamide Formula: C22H25Cl2N3O4 MolecularWeight: 466.3576

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2CN(CCC2=C1)C(=O)NCCC(=O)NCC3=CC(=C(C=C3)Cl)Cl)OC

Isomeric SMILES

COC1=C(C=C2CN(CCC2=C1)C(=O)NCCC(=O)NCC3=CC(=C(C=C3)Cl)Cl)OC

InChI

InChI=1S/C22H25Cl2N3O4/c1-30-19-10-15-6-8-27(13-16(15)11-20(19)31-2)22(29)25-7-5-21(28)26-12-14-3-4-17(23)18(24)9-14/h3-4,9-11H,5-8,12-13H2,1-2H3,(H,25,29)(H,26,28)