2-[[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxidanylidene-ethyl]-(4-methoxyphenyl)amino]ethanoic acid

Systemtic Name: 2-[[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxidanylidene-ethyl]-(4-methoxyphenyl)amino]ethanoic acid Openeye Name: 2-(N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxo-ethyl]-4-methoxy-anilino)acetic acid CAS Name: 2-(N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethyl]-4-methoxyanilino)acetic acid IUPAC Name: 2-(N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethyl]-4-methoxyanilino)acetic acid Traditional Name: 2-(N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-keto-ethyl]-4-methoxy-anilino)acetic acid Formula: C20H22N2O4 MolecularWeight: 354.39968

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N(CC(=O)N2CCC3=CC=CC=C3C2)CC(=O)O

Isomeric SMILES

COC1=CC=C(C=C1)N(CC(=O)N2CCC3=CC=CC=C3C2)CC(=O)O

InChI

InChI=1S/C20H22N2O4/c1-26-18-8-6-17(7-9-18)22(14-20(24)25)13-19(23)21-11-10-15-4-2-3-5-16(15)12-21/h2-9H,10-14H2,1H3,(H,24,25)