2-[2-[(3,4-dimethoxyphenyl)carbamoyl]-6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-1-yl]ethanoic acid

Systemtic Name: 2-[2-[(3,4-dimethoxyphenyl)carbamoyl]-6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-1-yl]ethanoic acid Openeye Name: 2-[2-[(3,4-dimethoxyphenyl)carbamoyl]-6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-1-yl]acetic acid CAS Name: 2-[2-[(3,4-dimethoxyanilino)-oxomethyl]-6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-1-yl]acetic acid IUPAC Name: 2-[2-[(3,4-dimethoxyphenyl)carbamoyl]-6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-1-yl]acetic acid Traditional Name: 2-[2-[(3,4-dimethoxyphenyl)carbamoyl]-6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-1-yl]acetic acid Formula: C22H26N2O7 MolecularWeight: 430.45104

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)NC(=O)N2CCC3=CC(=C(C=C3C2CC(=O)O)OC)OC)OC

Isomeric SMILES

COC1=C(C=C(C=C1)NC(=O)N2CCC3=CC(=C(C=C3C2CC(=O)O)OC)OC)OC

InChI

InChI=1S/C22H26N2O7/c1-28-17-6-5-14(10-19(17)30-3)23-22(27)24-8-7-13-9-18(29-2)20(31-4)11-15(13)16(24)12-21(25)26/h5-6,9-11,16H,7-8,12H2,1-4H3,(H,23,27)(H,25,26)