2-[2-[(2-azanyl-3-phenyl-propanoyl)amino]pyrrolidin-1-yl]-1-cyclopropyl-6-fluoranyl-4-oxidanylidene-1,8-naphthyridine-3-carboxylic acid

Systemtic Name: 2-[2-[(2-azanyl-3-phenyl-propanoyl)amino]pyrrolidin-1-yl]-1-cyclopropyl-6-fluoranyl-4-oxidanylidene-1,8-naphthyridine-3-carboxylic acid Openeye Name: 2-[2-[(2-amino-3-phenyl-propanoyl)amino]pyrrolidin-1-yl]-1-cyclopropyl-6-fluoro-4-oxo-1,8-naphthyridine-3-carboxylic acid CAS Name: 2-[2-[(2-amino-1-oxo-3-phenylpropyl)amino]-1-pyrrolidinyl]-1-cyclopropyl-6-fluoro-4-oxo-1,8-naphthyridine-3-carboxylic acid IUPAC Name: 2-[2-[(2-amino-3-phenylpropanoyl)amino]pyrrolidin-1-yl]-1-cyclopropyl-6-fluoro-4-oxo-1,8-naphthyridine-3-carboxylic acid Traditional Name: 1-cyclopropyl-6-fluoro-4-keto-2-[2-(phenylalanylamino)pyrrolidino]-1,8-naphthyridine-3-carboxylic acid Formula: C25H26FN5O4 MolecularWeight: 479.503443

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C2=C(C(=O)C3=CC(=CN=C3N2C4CC4)F)C(=O)O)NC(=O)C(CC5=CC=CC=C5)N

Isomeric SMILES

C1CC(N(C1)C2=C(C(=O)C3=CC(=CN=C3N2C4CC4)F)C(=O)O)NC(=O)C(CC5=CC=CC=C5)N

InChI

InChI=1S/C25H26FN5O4/c26-15-12-17-21(32)20(25(34)35)24(31(16-8-9-16)22(17)28-13-15)30-10-4-7-19(30)29-23(33)18(27)11-14-5-2-1-3-6-14/h1-3,5-6,12-13,16,18-19H,4,7-11,27H2,(H,29,33)(H,34,35)