2-[(2,3-dimethoxyphenyl)methoxycarbonylamino]-3-(1H-indol-3-yl)propanoic acid

Systemtic Name: 2-[(2,3-dimethoxyphenyl)methoxycarbonylamino]-3-(1H-indol-3-yl)propanoic acid Openeye Name: 2-[(2,3-dimethoxyphenyl)methoxycarbonylamino]-3-(1H-indol-3-yl)propanoic acid CAS Name: 2-[[(2,3-dimethoxyphenyl)methoxy-oxomethyl]amino]-3-(1H-indol-3-yl)propanoic acid IUPAC Name: 2-[(2,3-dimethoxyphenyl)methoxycarbonylamino]-3-(1H-indol-3-yl)propanoic acid Traditional Name: 3-(1H-indol-3-yl)-2-(o-veratryloxycarbonylamino)propionic acid Formula: C21H22N2O6 MolecularWeight: 398.40918

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1OC)COC(=O)NC(CC2=CNC3=CC=CC=C32)C(=O)O

Isomeric SMILES

COC1=CC=CC(=C1OC)COC(=O)NC(CC2=CNC3=CC=CC=C32)C(=O)O

InChI

InChI=1S/C21H22N2O6/c1-27-18-9-5-6-13(19(18)28-2)12-29-21(26)23-17(20(24)25)10-14-11-22-16-8-4-3-7-15(14)16/h3-9,11,17,22H,10,12H2,1-2H3,(H,23,26)(H,24,25)