3-[8-(hydroxymethyl)-9-oxidanylidene-2-phenylmethoxy-11H-indolizino[1,2-b]quinolin-7-yl]-3-oxidanyl-pentanoic acid

Systemtic Name: 3-[8-(hydroxymethyl)-9-oxidanylidene-2-phenylmethoxy-11H-indolizino[1,2-b]quinolin-7-yl]-3-oxidanyl-pentanoic acid Openeye Name: 3-[2-benzyloxy-8-(hydroxymethyl)-9-oxo-11H-indolizino[1,2-b]quinolin-7-yl]-3-hydroxy-pentanoic acid CAS Name: 3-hydroxy-3-[8-(hydroxymethyl)-9-oxo-2-phenylmethoxy-11H-indolizino[1,2-b]quinolin-7-yl]pentanoic acid IUPAC Name: 3-hydroxy-3-[8-(hydroxymethyl)-9-oxo-2-phenylmethoxy-11H-indolizino[1,2-b]quinolin-7-yl]pentanoic acid Traditional Name: 3-(2-benzoxy-9-keto-8-methylol-11H-indolizino[1,2-b]quinolin-7-yl)-3-hydroxy-valeric acid Formula: C28H26N2O6 MolecularWeight: 486.51584

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC(=O)O)(C1=C(C(=O)N2CC3=C(C2=C1)N=C4C=CC(=CC4=C3)OCC5=CC=CC=C5)CO)O

Isomeric SMILES

CCC(CC(=O)O)(C1=C(C(=O)N2CC3=C(C2=C1)N=C4C=CC(=CC4=C3)OCC5=CC=CC=C5)CO)O

InChI

InChI=1S/C28H26N2O6/c1-2-28(35,13-25(32)33)22-12-24-26-19(14-30(24)27(34)21(22)15-31)10-18-11-20(8-9-23(18)29-26)36-16-17-6-4-3-5-7-17/h3-12,31,35H,2,13-16H2,1H3,(H,32,33)