2-[2-(2,3-dihydro-1,4-benzodioxin-6-ylcarbamoyl)-3,4-dihydro-1H-isoquinolin-1-yl]ethanoic acid

Systemtic Name: 2-[2-(2,3-dihydro-1,4-benzodioxin-6-ylcarbamoyl)-3,4-dihydro-1H-isoquinolin-1-yl]ethanoic acid Openeye Name: 2-[2-(2,3-dihydro-1,4-benzodioxin-6-ylcarbamoyl)-3,4-dihydro-1H-isoquinolin-1-yl]acetic acid CAS Name: 2-[2-[(2,3-dihydro-1,4-benzodioxin-6-ylamino)-oxomethyl]-3,4-dihydro-1H-isoquinolin-1-yl]acetic acid IUPAC Name: 2-[2-(2,3-dihydro-1,4-benzodioxin-6-ylcarbamoyl)-3,4-dihydro-1H-isoquinolin-1-yl]acetic acid Traditional Name: 2-[2-(2,3-dihydro-1,4-benzodioxin-6-ylcarbamoyl)-3,4-dihydro-1H-isoquinolin-1-yl]acetic acid Formula: C20H20N2O5 MolecularWeight: 368.3832

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(C2=CC=CC=C21)CC(=O)O)C(=O)NC3=CC4=C(C=C3)OCCO4

Isomeric SMILES

C1CN(C(C2=CC=CC=C21)CC(=O)O)C(=O)NC3=CC4=C(C=C3)OCCO4

InChI

InChI=1S/C20H20N2O5/c23-19(24)12-16-15-4-2-1-3-13(15)7-8-22(16)20(25)21-14-5-6-17-18(11-14)27-10-9-26-17/h1-6,11,16H,7-10,12H2,(H,21,25)(H,23,24)