3-[(3S)-3-azaniumyl-3-(2-oxidanylnaphthalen-1-yl)propanoyl]-1-methyl-4-oxidanylidene-quinolin-2-olate

Systemtic Name: 3-[(3S)-3-azaniumyl-3-(2-oxidanylnaphthalen-1-yl)propanoyl]-1-methyl-4-oxidanylidene-quinolin-2-olate Openeye Name: 3-[(3S)-3-azaniumyl-3-(2-hydroxy-1-naphthyl)propanoyl]-1-methyl-4-oxo-quinolin-2-olate CAS Name: 3-[(3S)-3-ammonio-3-(2-hydroxy-1-naphthalenyl)-1-oxopropyl]-1-methyl-4-oxo-2-quinolinolate IUPAC Name: 3-[(3S)-3-azaniumyl-3-(2-hydroxynaphthalen-1-yl)propanoyl]-1-methyl-4-oxoquinolin-2-olate Traditional Name: 3-[(3S)-3-ammonio-3-(2-hydroxy-1-naphthyl)propanoyl]-4-keto-1-methyl-quinolin-2-olate Formula: C23H20N2O4 MolecularWeight: 388.4159

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2C(=O)C(=C1[O-])C(=O)CC(C3=C(C=CC4=CC=CC=C43)O)[NH3+]

Isomeric SMILES

CN1C2=CC=CC=C2C(=O)C(=C1[O-])C(=O)C[C@@H](C3=C(C=CC4=CC=CC=C43)O)[NH3+]

InChI

InChI=1S/C23H20N2O4/c1-25-17-9-5-4-8-15(17)22(28)21(23(25)29)19(27)12-16(24)20-14-7-3-2-6-13(14)10-11-18(20)26/h2-11,16,26,29H,12,24H2,1H3/t16-/m0/s1