1-(3-methylbutyl)-4-oxidanylidene-3-[[(1R)-1-phenylethyl]carbamoyl]quinolin-2-olate

Systemtic Name: 1-(3-methylbutyl)-4-oxidanylidene-3-[[(1R)-1-phenylethyl]carbamoyl]quinolin-2-olate Openeye Name: 1-isopentyl-4-oxo-3-[[(1R)-1-phenylethyl]carbamoyl]quinolin-2-olate CAS Name: 1-(3-methylbutyl)-4-oxo-3-[oxo-[[(1R)-1-phenylethyl]amino]methyl]-2-quinolinolate IUPAC Name: 1-(3-methylbutyl)-4-oxo-3-[[(1R)-1-phenylethyl]carbamoyl]quinolin-2-olate Traditional Name: 1-isoamyl-4-keto-3-[[(1R)-1-phenylethyl]carbamoyl]quinolin-2-olate Formula: C23H25N2O3- MolecularWeight: 377.4562

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCN1C2=CC=CC=C2C(=O)C(=C1[O-])C(=O)NC(C)C3=CC=CC=C3

Isomeric SMILES

C[C@H](C1=CC=CC=C1)NC(=O)C2=C(N(C3=CC=CC=C3C2=O)CCC(C)C)[O-]

InChI

InChI=1S/C23H26N2O3/c1-15(2)13-14-25-19-12-8-7-11-18(19)21(26)20(23(25)28)22(27)24-16(3)17-9-5-4-6-10-17/h4-12,15-16,28H,13-14H2,1-3H3,(H,24,27)/p-1/t16-/m1/s1