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

Systemtic Name: 2-[6,7-diethoxy-2-[(2-ethoxyphenyl)carbamoyl]-3,4-dihydro-1H-isoquinolin-1-yl]ethanoic acid Openeye Name: 2-[6,7-diethoxy-2-[(2-ethoxyphenyl)carbamoyl]-3,4-dihydro-1H-isoquinolin-1-yl]acetic acid CAS Name: 2-[6,7-diethoxy-2-[(2-ethoxyanilino)-oxomethyl]-3,4-dihydro-1H-isoquinolin-1-yl]acetic acid IUPAC Name: 2-[6,7-diethoxy-2-[(2-ethoxyphenyl)carbamoyl]-3,4-dihydro-1H-isoquinolin-1-yl]acetic acid Traditional Name: 2-[6,7-diethoxy-2-(o-phenetylcarbamoyl)-3,4-dihydro-1H-isoquinolin-1-yl]acetic acid Formula: C24H30N2O6 MolecularWeight: 442.5048

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1NC(=O)N2CCC3=CC(=C(C=C3C2CC(=O)O)OCC)OCC

Isomeric SMILES

CCOC1=CC=CC=C1NC(=O)N2CCC3=CC(=C(C=C3C2CC(=O)O)OCC)OCC

InChI

InChI=1S/C24H30N2O6/c1-4-30-20-10-8-7-9-18(20)25-24(29)26-12-11-16-13-21(31-5-2)22(32-6-3)14-17(16)19(26)15-23(27)28/h7-10,13-14,19H,4-6,11-12,15H2,1-3H3,(H,25,29)(H,27,28)