5-(4-ethoxycarbonylpiperazin-1-yl)-4-[[4-(1-methoxycarbonylcyclobutyl)oxy-7-methyl-quinolin-2-yl]carbonylamino]-5-oxidanylidene-pentanoic acid

Systemtic Name: 5-(4-ethoxycarbonylpiperazin-1-yl)-4-[[4-(1-methoxycarbonylcyclobutyl)oxy-7-methyl-quinolin-2-yl]carbonylamino]-5-oxidanylidene-pentanoic acid Openeye Name: 5-(4-ethoxycarbonylpiperazin-1-yl)-4-[[4-(1-methoxycarbonylcyclobutoxy)-7-methyl-quinoline-2-carbonyl]amino]-5-oxo-pentanoic acid CAS Name: 5-(4-ethoxycarbonyl-1-piperazinyl)-4-[[[4-(1-methoxycarbonylcyclobutyl)oxy-7-methyl-2-quinolinyl]-oxomethyl]amino]-5-oxopentanoic acid IUPAC Name: 5-(4-ethoxycarbonylpiperazin-1-yl)-4-[[4-(1-methoxycarbonylcyclobutyl)oxy-7-methylquinoline-2-carbonyl]amino]-5-oxopentanoic acid Traditional Name: 5-(4-carbethoxypiperazino)-4-[[4-(1-carbomethoxycyclobutoxy)-7-methyl-quinoline-2-carbonyl]amino]-5-keto-valeric acid Formula: C29H36N4O9 MolecularWeight: 584.61754

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C(=O)C(CCC(=O)O)NC(=O)C2=NC3=C(C=CC(=C3)C)C(=C2)OC4(CCC4)C(=O)OC

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C(=O)C(CCC(=O)O)NC(=O)C2=NC3=C(C=CC(=C3)C)C(=C2)OC4(CCC4)C(=O)OC

InChI

InChI=1S/C29H36N4O9/c1-4-41-28(39)33-14-12-32(13-15-33)26(37)20(8-9-24(34)35)31-25(36)22-17-23(19-7-6-18(2)16-21(19)30-22)42-29(10-5-11-29)27(38)40-3/h6-7,16-17,20H,4-5,8-15H2,1-3H3,(H,31,36)(H,34,35)