2-[[6-(3-methylbutylcarbamoyl)-2,3-dihydro-1H-cyclopenta[b]quinolin-9-yl]sulfanyl]ethanoic acid

Systemtic Name: 2-[[6-(3-methylbutylcarbamoyl)-2,3-dihydro-1H-cyclopenta[b]quinolin-9-yl]sulfanyl]ethanoic acid Openeye Name: 2-[[6-(isopentylcarbamoyl)-2,3-dihydro-1H-cyclopenta[b]quinolin-9-yl]sulfanyl]acetic acid CAS Name: 2-[[6-[(3-methylbutylamino)-oxomethyl]-2,3-dihydro-1H-cyclopenta[b]quinolin-9-yl]thio]acetic acid IUPAC Name: 2-[[6-(3-methylbutylcarbamoyl)-2,3-dihydro-1H-cyclopenta[b]quinolin-9-yl]sulfanyl]acetic acid Traditional Name: 2-[[6-(isoamylcarbamoyl)-2,3-dihydro-1H-cyclopenta[b]quinolin-9-yl]thio]acetic acid Formula: C20H24N2O3S MolecularWeight: 372.48116

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCNC(=O)C1=CC2=C(C=C1)C(=C3CCCC3=N2)SCC(=O)O

Isomeric SMILES

CC(C)CCNC(=O)C1=CC2=C(C=C1)C(=C3CCCC3=N2)SCC(=O)O

InChI

InChI=1S/C20H24N2O3S/c1-12(2)8-9-21-20(25)13-6-7-15-17(10-13)22-16-5-3-4-14(16)19(15)26-11-18(23)24/h6-7,10,12H,3-5,8-9,11H2,1-2H3,(H,21,25)(H,23,24)