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

Systemtic Name: 2-[2-[(2,4-dimethoxyphenyl)carbamoyl]-3,4-dihydro-1H-isoquinolin-1-yl]ethanoic acid Openeye Name: 2-[2-[(2,4-dimethoxyphenyl)carbamoyl]-3,4-dihydro-1H-isoquinolin-1-yl]acetic acid CAS Name: 2-[2-[(2,4-dimethoxyanilino)-oxomethyl]-3,4-dihydro-1H-isoquinolin-1-yl]acetic acid IUPAC Name: 2-[2-[(2,4-dimethoxyphenyl)carbamoyl]-3,4-dihydro-1H-isoquinolin-1-yl]acetic acid Traditional Name: 2-[2-[(2,4-dimethoxyphenyl)carbamoyl]-3,4-dihydro-1H-isoquinolin-1-yl]acetic acid Formula: C20H22N2O5 MolecularWeight: 370.39908

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H22N2O5/c1-26-14-7-8-16(18(11-14)27-2)21-20(25)22-10-9-13-5-3-4-6-15(13)17(22)12-19(23)24/h3-8,11,17H,9-10,12H2,1-2H3,(H,21,25)(H,23,24)