2-azanyl-1-cyclopropyl-7-(2,6-dimethylpyridin-4-yl)-8-methyl-4-oxidanylidene-5-phenylmethoxycarbonyl-quinoline-3-carboxylic acid

Systemtic Name: 2-azanyl-1-cyclopropyl-7-(2,6-dimethylpyridin-4-yl)-8-methyl-4-oxidanylidene-5-phenylmethoxycarbonyl-quinoline-3-carboxylic acid Openeye Name: 2-amino-5-benzyloxycarbonyl-1-cyclopropyl-7-(2,6-dimethyl-4-pyridyl)-8-methyl-4-oxo-quinoline-3-carboxylic acid CAS Name: 2-amino-1-cyclopropyl-7-(2,6-dimethyl-4-pyridinyl)-8-methyl-4-oxo-5-phenylmethoxycarbonyl-3-quinolinecarboxylic acid IUPAC Name: 2-amino-1-cyclopropyl-7-(2,6-dimethylpyridin-4-yl)-8-methyl-4-oxo-5-phenylmethoxycarbonylquinoline-3-carboxylic acid Traditional Name: 2-amino-5-carbobenzoxy-1-cyclopropyl-7-(2,6-dimethyl-4-pyridyl)-4-keto-8-methyl-quinoline-3-carboxylic acid Formula: C29H27N3O5 MolecularWeight: 497.54178

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=N1)C)C2=CC(=C3C(=C2C)N(C(=C(C3=O)C(=O)O)N)C4CC4)C(=O)OCC5=CC=CC=C5

Isomeric SMILES

CC1=CC(=CC(=N1)C)C2=CC(=C3C(=C2C)N(C(=C(C3=O)C(=O)O)N)C4CC4)C(=O)OCC5=CC=CC=C5

InChI

InChI=1S/C29H27N3O5/c1-15-11-19(12-16(2)31-15)21-13-22(29(36)37-14-18-7-5-4-6-8-18)23-25(17(21)3)32(20-9-10-20)27(30)24(26(23)33)28(34)35/h4-8,11-13,20H,9-10,14,30H2,1-3H3,(H,34,35)