(2S)-2-azanyl-4-methyl-pentanoate; 1-cyclopropyl-6-fluoranyl-4-oxidanylidene-7-piperazin-1-yl-quinoline-3-carboxylate; oxygen(2-); vanadium(4+)

Systemtic Name: (2S)-2-azanyl-4-methyl-pentanoate; 1-cyclopropyl-6-fluoranyl-4-oxidanylidene-7-piperazin-1-yl-quinoline-3-carboxylate; oxygen(2-); vanadium(4+) Openeye Name: (2S)-2-amino-4-methyl-pentanoate; 1-cyclopropyl-6-fluoro-4-oxo-7-piperazin-1-yl-quinoline-3-carboxylate; oxygen(2-); vanadium(4+) CAS Name: (2S)-2-amino-4-methylpentanoate; 1-cyclopropyl-6-fluoro-4-oxo-7-(1-piperazinyl)-3-quinolinecarboxylate; oxygen(2-); vanadium(4+) IUPAC Name: (2S)-2-amino-4-methylpentanoate; 1-cyclopropyl-6-fluoro-4-oxo-7-piperazin-1-ylquinoline-3-carboxylate; oxygen(2-); vanadium(4+) Traditional Name: (2S)-2-amino-4-methyl-valerate; 1-cyclopropyl-6-fluoro-4-keto-7-piperazino-quinoline-3-carboxylate; oxygen(2-); vanadium(4+) Formula: C23H29FN4O6V MolecularWeight: 527.439463

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)[O-])N.C1CC1N2C=C(C(=O)C3=CC(=C(C=C32)N4CCNCC4)F)C(=O)[O-].[O-2].[V+4]

Isomeric SMILES

CC(C)C[C@@H](C(=O)[O-])N.C1CC1N2C=C(C(=O)C3=CC(=C(C=C32)N4CCNCC4)F)C(=O)[O-].[O-2].[V+4]

InChI

InChI=1S/C17H18FN3O3.C6H13NO2.O.V/c18-13-7-11-14(8-15(13)20-5-3-19-4-6-20)21(10-1-2-10)9-12(16(11)22)17(23)24;1-4(2)3-5(7)6(8)9;;/h7-10,19H,1-6H2,(H,23,24);4-5H,3,7H2,1-2H3,(H,8,9);;/q;;-2;+4/p-2/t;5-;;/m.0../s1