2-(3-ethoxy-4-propan-2-yloxy-phenyl)-2-[[2-[(2-methylpropan-2-yl)oxycarbonyl]-3,4-dihydro-1H-isoquinolin-7-yl]amino]ethanoic acid

Systemtic Name: 2-(3-ethoxy-4-propan-2-yloxy-phenyl)-2-[[2-[(2-methylpropan-2-yl)oxycarbonyl]-3,4-dihydro-1H-isoquinolin-7-yl]amino]ethanoic acid Openeye Name: 2-[(2-tert-butoxycarbonyl-3,4-dihydro-1H-isoquinolin-7-yl)amino]-2-(3-ethoxy-4-isopropoxy-phenyl)acetic acid CAS Name: 2-(3-ethoxy-4-propan-2-yloxyphenyl)-2-[[2-[(2-methylpropan-2-yl)oxy-oxomethyl]-3,4-dihydro-1H-isoquinolin-7-yl]amino]acetic acid IUPAC Name: 2-(3-ethoxy-4-propan-2-yloxyphenyl)-2-[[2-[(2-methylpropan-2-yl)oxycarbonyl]-3,4-dihydro-1H-isoquinolin-7-yl]amino]acetic acid Traditional Name: 2-[(2-tert-butoxycarbonyl-3,4-dihydro-1H-isoquinolin-7-yl)amino]-2-(3-ethoxy-4-isopropoxy-phenyl)acetic acid Formula: C27H36N2O6 MolecularWeight: 484.58454

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C(C(=O)O)NC2=CC3=C(CCN(C3)C(=O)OC(C)(C)C)C=C2)OC(C)C

Isomeric SMILES

CCOC1=C(C=CC(=C1)C(C(=O)O)NC2=CC3=C(CCN(C3)C(=O)OC(C)(C)C)C=C2)OC(C)C

InChI

InChI=1S/C27H36N2O6/c1-7-33-23-15-19(9-11-22(23)34-17(2)3)24(25(30)31)28-21-10-8-18-12-13-29(16-20(18)14-21)26(32)35-27(4,5)6/h8-11,14-15,17,24,28H,7,12-13,16H2,1-6H3,(H,30,31)