1-[8-(chloromethyl)-9-oxidanylidene-11H-indolizino[1,2-b]quinolin-7-yl]propyl benzoate

Systemtic Name: 1-[8-(chloromethyl)-9-oxidanylidene-11H-indolizino[1,2-b]quinolin-7-yl]propyl benzoate Openeye Name: 1-[8-(chloromethyl)-9-oxo-11H-indolizino[1,2-b]quinolin-7-yl]propyl benzoate CAS Name: benzoic acid 1-[8-(chloromethyl)-9-oxo-11H-indolizino[1,2-b]quinolin-7-yl]propyl ester IUPAC Name: 1-[8-(chloromethyl)-9-oxo-11H-indolizino[1,2-b]quinolin-7-yl]propyl benzoate Traditional Name: benzoic acid 1-[8-(chloromethyl)-9-keto-11H-indolizino[1,2-b]quinolin-7-yl]propyl ester Formula: C26H21ClN2O3 MolecularWeight: 444.90954

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=C(C(=O)N2CC3=CC4=CC=CC=C4N=C3C2=C1)CCl)OC(=O)C5=CC=CC=C5

Isomeric SMILES

CCC(C1=C(C(=O)N2CC3=CC4=CC=CC=C4N=C3C2=C1)CCl)OC(=O)C5=CC=CC=C5

InChI

InChI=1S/C26H21ClN2O3/c1-2-23(32-26(31)16-8-4-3-5-9-16)19-13-22-24-18(15-29(22)25(30)20(19)14-27)12-17-10-6-7-11-21(17)28-24/h3-13,23H,2,14-15H2,1H3