1-cyclopropyl-8-methyl-7-[5-methyl-6-[[methyl(phenylmethoxycarbonyl)amino]methyl]pyridin-3-yl]-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 1-cyclopropyl-8-methyl-7-[5-methyl-6-[[methyl(phenylmethoxycarbonyl)amino]methyl]pyridin-3-yl]-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 7-[6-[[benzyloxycarbonyl(methyl)amino]methyl]-5-methyl-3-pyridyl]-1-cyclopropyl-8-methyl-4-oxo-quinoline-3-carboxylic acid CAS Name: 1-cyclopropyl-8-methyl-7-[5-methyl-6-[[methyl(phenylmethoxycarbonyl)amino]methyl]-3-pyridinyl]-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 1-cyclopropyl-8-methyl-7-[5-methyl-6-[[methyl(phenylmethoxycarbonyl)amino]methyl]pyridin-3-yl]-4-oxoquinoline-3-carboxylic acid Traditional Name: 7-[6-[[carbobenzoxy(methyl)amino]methyl]-5-methyl-3-pyridyl]-1-cyclopropyl-4-keto-8-methyl-quinoline-3-carboxylic acid Formula: C30H29N3O5 MolecularWeight: 511.56836

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=CC(=C1)C2=C(C3=C(C=C2)C(=O)C(=CN3C4CC4)C(=O)O)C)CN(C)C(=O)OCC5=CC=CC=C5

Isomeric SMILES

CC1=C(N=CC(=C1)C2=C(C3=C(C=C2)C(=O)C(=CN3C4CC4)C(=O)O)C)CN(C)C(=O)OCC5=CC=CC=C5

InChI

InChI=1S/C30H29N3O5/c1-18-13-21(14-31-26(18)16-32(3)30(37)38-17-20-7-5-4-6-8-20)23-11-12-24-27(19(23)2)33(22-9-10-22)15-25(28(24)34)29(35)36/h4-8,11-15,22H,9-10,16-17H2,1-3H3,(H,35,36)