3-[5-[(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)carbonyl]pyrrolidin-3-yl]oxybenzenecarboximidamide

Systemtic Name: 3-[5-[(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)carbonyl]pyrrolidin-3-yl]oxybenzenecarboximidamide Openeye Name: 3-[5-(6,7-dimethoxy-3,4-dihydro-1H-isoquinoline-2-carbonyl)pyrrolidin-3-yl]oxybenzamidine CAS Name: 3-[[5-[(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-oxomethyl]-3-pyrrolidinyl]oxy]benzenecarboximidamide IUPAC Name: 3-[5-(6,7-dimethoxy-3,4-dihydro-1H-isoquinoline-2-carbonyl)pyrrolidin-3-yl]oxybenzenecarboximidamide Traditional Name: 3-[5-(6,7-dimethoxy-3,4-dihydro-1H-isoquinoline-2-carbonyl)pyrrolidin-3-yl]oxybenzamidine Formula: C23H28N4O4 MolecularWeight: 424.49282

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2CN(CCC2=C1)C(=O)C3CC(CN3)OC4=CC=CC(=C4)C(=N)N)OC

Isomeric SMILES

COC1=C(C=C2CN(CCC2=C1)C(=O)C3CC(CN3)OC4=CC=CC(=C4)C(=N)N)OC

InChI

InChI=1S/C23H28N4O4/c1-29-20-9-14-6-7-27(13-16(14)10-21(20)30-2)23(28)19-11-18(12-26-19)31-17-5-3-4-15(8-17)22(24)25/h3-5,8-10,18-19,26H,6-7,11-13H2,1-2H3,(H3,24,25)