5-azanyl-1-cyclopropyl-7-[3-[dimethylamino(1,3-oxazol-2-yl)methyl]pyrrolidin-1-yl]-8-methyl-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 5-azanyl-1-cyclopropyl-7-[3-[dimethylamino(1,3-oxazol-2-yl)methyl]pyrrolidin-1-yl]-8-methyl-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 5-amino-1-cyclopropyl-7-[3-[dimethylamino(oxazol-2-yl)methyl]pyrrolidin-1-yl]-8-methyl-4-oxo-quinoline-3-carboxylic acid CAS Name: 5-amino-1-cyclopropyl-7-[3-[dimethylamino(2-oxazolyl)methyl]-1-pyrrolidinyl]-8-methyl-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 5-amino-1-cyclopropyl-7-[3-[dimethylamino(1,3-oxazol-2-yl)methyl]pyrrolidin-1-yl]-8-methyl-4-oxoquinoline-3-carboxylic acid Traditional Name: 5-amino-1-cyclopropyl-7-[3-[dimethylamino(oxazol-2-yl)methyl]pyrrolidino]-4-keto-8-methyl-quinoline-3-carboxylic acid Formula: C24H29N5O4 MolecularWeight: 451.51816

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=C(C=C1N3CCC(C3)C(C4=NC=CO4)N(C)C)N)C(=O)C(=CN2C5CC5)C(=O)O

Isomeric SMILES

CC1=C2C(=C(C=C1N3CCC(C3)C(C4=NC=CO4)N(C)C)N)C(=O)C(=CN2C5CC5)C(=O)O

InChI

InChI=1S/C24H29N5O4/c1-13-18(28-8-6-14(11-28)21(27(2)3)23-26-7-9-33-23)10-17(25)19-20(13)29(15-4-5-15)12-16(22(19)30)24(31)32/h7,9-10,12,14-15,21H,4-6,8,11,25H2,1-3H3,(H,31,32)