2,3-dihydro-1H-cyclopenta[b]quinolin-9-amine; 2-oxidanyl-5-sulfo-benzoic acid

Systemtic Name: 2,3-dihydro-1H-cyclopenta[b]quinolin-9-amine; 2-oxidanyl-5-sulfo-benzoic acid Openeye Name: 2,3-dihydro-1H-cyclopenta[b]quinolin-9-amine; 2-hydroxy-5-sulfo-benzoic acid CAS Name: 2,3-dihydro-1H-cyclopenta[b]quinolin-9-amine; 2-hydroxy-5-sulfobenzoic acid IUPAC Name: 2,3-dihydro-1H-cyclopenta[b]quinolin-9-amine; 2-hydroxy-5-sulfobenzoic acid Traditional Name: 2,3-dihydro-1H-cyclopenta[b]quinolin-9-ylamine; 2-hydroxy-5-sulfo-benzoic acid Formula: C19H18N2O6S MolecularWeight: 402.42102

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C3=CC=CC=C3N=C2C1)N.C1=CC(=C(C=C1S(=O)(=O)O)C(=O)O)O

Isomeric SMILES

C1CC2=C(C3=CC=CC=C3N=C2C1)N.C1=CC(=C(C=C1S(=O)(=O)O)C(=O)O)O

InChI

InChI=1S/C12H12N2.C7H6O6S/c13-12-8-4-1-2-6-10(8)14-11-7-3-5-9(11)12;8-6-2-1-4(14(11,12)13)3-5(6)7(9)10/h1-2,4,6H,3,5,7H2,(H2,13,14);1-3,8H,(H,9,10)(H,11,12,13)