3-[[8-(1-azanylpentoxy)-4-oxidanylidene-quinolizin-2-yl]carbonylamino]-2-(phenylsulfonylamino)propanoic acid

Systemtic Name: 3-[[8-(1-azanylpentoxy)-4-oxidanylidene-quinolizin-2-yl]carbonylamino]-2-(phenylsulfonylamino)propanoic acid Openeye Name: 3-[[8-(1-aminopentoxy)-4-oxo-quinolizine-2-carbonyl]amino]-2-(benzenesulfonamido)propanoic acid CAS Name: 3-[[[8-(1-aminopentoxy)-4-oxo-2-quinolizinyl]-oxomethyl]amino]-2-(benzenesulfonamido)propanoic acid IUPAC Name: 3-[[8-(1-aminopentoxy)-4-oxoquinolizine-2-carbonyl]amino]-2-(benzenesulfonamido)propanoic acid Traditional Name: 3-[[8-(1-aminopentoxy)-4-keto-quinolizine-2-carbonyl]amino]-2-(benzenesulfonamido)propionic acid Formula: C24H28N4O7S MolecularWeight: 516.56672

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(N)OC1=CC2=CC(=CC(=O)N2C=C1)C(=O)NCC(C(=O)O)NS(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

CCCCC(N)OC1=CC2=CC(=CC(=O)N2C=C1)C(=O)NCC(C(=O)O)NS(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C24H28N4O7S/c1-2-3-9-21(25)35-18-10-11-28-17(14-18)12-16(13-22(28)29)23(30)26-15-20(24(31)32)27-36(33,34)19-7-5-4-6-8-19/h4-8,10-14,20-21,27H,2-3,9,15,25H2,1H3,(H,26,30)(H,31,32)