5-[4-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)butyl]-3-phenyl-quinoxaline-2-carboxamide

Systemtic Name: 5-[4-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)butyl]-3-phenyl-quinoxaline-2-carboxamide Openeye Name: 5-[4-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)butyl]-3-phenyl-quinoxaline-2-carboxamide CAS Name: 5-[4-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)butyl]-3-phenyl-2-quinoxalinecarboxamide IUPAC Name: 5-[4-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)butyl]-3-phenylquinoxaline-2-carboxamide Traditional Name: 5-[4-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)butyl]-3-phenyl-quinoxaline-2-carboxamide Formula: C30H32N4O3 MolecularWeight: 496.60008

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2CN(CCC2=C1)CCCCC3=C4C(=CC=C3)N=C(C(=N4)C5=CC=CC=C5)C(=O)N)OC

Isomeric SMILES

COC1=C(C=C2CN(CCC2=C1)CCCCC3=C4C(=CC=C3)N=C(C(=N4)C5=CC=CC=C5)C(=O)N)OC

InChI

InChI=1S/C30H32N4O3/c1-36-25-17-22-14-16-34(19-23(22)18-26(25)37-2)15-7-6-11-20-12-8-13-24-27(20)33-28(29(32-24)30(31)35)21-9-4-3-5-10-21/h3-5,8-10,12-13,17-18H,6-7,11,14-16,19H2,1-2H3,(H2,31,35)