N-[(3,4-dimethoxyphenyl)methyl]-2-(2,5-dimethoxyphenyl)sulfonyl-3,4-dihydro-1H-isoquinoline-3-carboxamide

Systemtic Name: N-[(3,4-dimethoxyphenyl)methyl]-2-(2,5-dimethoxyphenyl)sulfonyl-3,4-dihydro-1H-isoquinoline-3-carboxamide Openeye Name: N-[(3,4-dimethoxyphenyl)methyl]-2-(2,5-dimethoxyphenyl)sulfonyl-3,4-dihydro-1H-isoquinoline-3-carboxamide CAS Name: N-[(3,4-dimethoxyphenyl)methyl]-2-(2,5-dimethoxyphenyl)sulfonyl-3,4-dihydro-1H-isoquinoline-3-carboxamide IUPAC Name: N-[(3,4-dimethoxyphenyl)methyl]-2-(2,5-dimethoxyphenyl)sulfonyl-3,4-dihydro-1H-isoquinoline-3-carboxamide Traditional Name: 2-(2,5-dimethoxyphenyl)sulfonyl-N-veratryl-3,4-dihydro-1H-isoquinoline-3-carboxamide Formula: C27H30N2O7S MolecularWeight: 526.6013

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC)S(=O)(=O)N2CC3=CC=CC=C3CC2C(=O)NCC4=CC(=C(C=C4)OC)OC

Isomeric SMILES

COC1=CC(=C(C=C1)OC)S(=O)(=O)N2CC3=CC=CC=C3CC2C(=O)NCC4=CC(=C(C=C4)OC)OC

InChI

InChI=1S/C27H30N2O7S/c1-33-21-10-12-24(35-3)26(15-21)37(31,32)29-17-20-8-6-5-7-19(20)14-22(29)27(30)28-16-18-9-11-23(34-2)25(13-18)36-4/h5-13,15,22H,14,16-17H2,1-4H3,(H,28,30)