methyl 3-[3,4-bis(oxidanyl)phenyl]-3-oxidanyl-2-(1-phenoxypropan-2-ylamino)propanoate

Systemtic Name: methyl 3-[3,4-bis(oxidanyl)phenyl]-3-oxidanyl-2-(1-phenoxypropan-2-ylamino)propanoate Openeye Name: methyl 3-(3,4-dihydroxyphenyl)-3-hydroxy-2-[(1-methyl-2-phenoxy-ethyl)amino]propanoate CAS Name: 3-(3,4-dihydroxyphenyl)-3-hydroxy-2-(1-phenoxypropan-2-ylamino)propanoic acid methyl ester IUPAC Name: methyl 3-(3,4-dihydroxyphenyl)-3-hydroxy-2-(1-phenoxypropan-2-ylamino)propanoate Traditional Name: 3-(3,4-dihydroxyphenyl)-3-hydroxy-2-[(1-methyl-2-phenoxy-ethyl)amino]propionic acid methyl ester Formula: C19H23NO6 MolecularWeight: 361.38902

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Descriptors Computed from Structure

Canonical SMILES:

CC(COC1=CC=CC=C1)NC(C(C2=CC(=C(C=C2)O)O)O)C(=O)OC

Isomeric SMILES

CC(COC1=CC=CC=C1)NC(C(C2=CC(=C(C=C2)O)O)O)C(=O)OC

InChI

InChI=1S/C19H23NO6/c1-12(11-26-14-6-4-3-5-7-14)20-17(19(24)25-2)18(23)13-8-9-15(21)16(22)10-13/h3-10,12,17-18,20-23H,11H2,1-2H3