2,4-dimethyl-7,8,9,10-tetrahydro-6H-cyclohepta[b]quinolin-11-amine; 2-oxidanyl-5-sulfo-benzoic acid

Systemtic Name: 2,4-dimethyl-7,8,9,10-tetrahydro-6H-cyclohepta[b]quinolin-11-amine; 2-oxidanyl-5-sulfo-benzoic acid Openeye Name: 2,4-dimethyl-7,8,9,10-tetrahydro-6H-cyclohepta[b]quinolin-11-amine; 2-hydroxy-5-sulfo-benzoic acid CAS Name: 2,4-dimethyl-7,8,9,10-tetrahydro-6H-cyclohepta[b]quinolin-11-amine; 2-hydroxy-5-sulfobenzoic acid IUPAC Name: 2,4-dimethyl-7,8,9,10-tetrahydro-6H-cyclohepta[b]quinolin-11-amine; 2-hydroxy-5-sulfobenzoic acid Traditional Name: (2,4-dimethyl-7,8,9,10-tetrahydro-6H-cyclohepta[b]quinolin-11-yl)amine; 2-hydroxy-5-sulfo-benzoic acid Formula: C23H26N2O6S MolecularWeight: 458.52734

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=C1)C(=C3CCCCCC3=N2)N)C.C1=CC(=C(C=C1S(=O)(=O)O)C(=O)O)O

Isomeric SMILES

CC1=CC(=C2C(=C1)C(=C3CCCCCC3=N2)N)C.C1=CC(=C(C=C1S(=O)(=O)O)C(=O)O)O

InChI

InChI=1S/C16H20N2.C7H6O6S/c1-10-8-11(2)16-13(9-10)15(17)12-6-4-3-5-7-14(12)18-16;8-6-2-1-4(14(11,12)13)3-5(6)7(9)10/h8-9H,3-7H2,1-2H3,(H2,17,18);1-3,8H,(H,9,10)(H,11,12,13)