3-[(3R)-3-(1,3-benzodioxol-5-yl)-3-[(4-methoxyphenyl)amino]propanoyl]-1-methyl-4-oxidanylidene-quinolin-2-olate

Systemtic Name: 3-[(3R)-3-(1,3-benzodioxol-5-yl)-3-[(4-methoxyphenyl)amino]propanoyl]-1-methyl-4-oxidanylidene-quinolin-2-olate Openeye Name: 3-[(3R)-3-(1,3-benzodioxol-5-yl)-3-(4-methoxyanilino)propanoyl]-1-methyl-4-oxo-quinolin-2-olate CAS Name: 3-[(3R)-3-(1,3-benzodioxol-5-yl)-3-(4-methoxyanilino)-1-oxopropyl]-1-methyl-4-oxo-2-quinolinolate IUPAC Name: 3-[(3R)-3-(1,3-benzodioxol-5-yl)-3-(4-methoxyanilino)propanoyl]-1-methyl-4-oxoquinolin-2-olate Traditional Name: 3-[(3R)-3-(1,3-benzodioxol-5-yl)-3-(p-anisidino)propanoyl]-4-keto-1-methyl-quinolin-2-olate Formula: C27H23N2O6- MolecularWeight: 471.48132

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2C(=O)C(=C1[O-])C(=O)CC(C3=CC4=C(C=C3)OCO4)NC5=CC=C(C=C5)OC

Isomeric SMILES

CN1C2=CC=CC=C2C(=O)C(=C1[O-])C(=O)C[C@H](C3=CC4=C(C=C3)OCO4)NC5=CC=C(C=C5)OC

InChI

InChI=1S/C27H24N2O6/c1-29-21-6-4-3-5-19(21)26(31)25(27(29)32)22(30)14-20(28-17-8-10-18(33-2)11-9-17)16-7-12-23-24(13-16)35-15-34-23/h3-13,20,28,32H,14-15H2,1-2H3/p-1/t20-/m1/s1