5-nitro-6-(2-propan-2-ylphenyl)sulfonyl-quinolin-8-amine

Systemtic Name: 5-nitro-6-(2-propan-2-ylphenyl)sulfonyl-quinolin-8-amine Openeye Name: 6-(2-isopropylphenyl)sulfonyl-5-nitro-quinolin-8-amine CAS Name: 5-nitro-6-(2-propan-2-ylphenyl)sulfonyl-8-quinolinamine IUPAC Name: 5-nitro-6-(2-propan-2-ylphenyl)sulfonylquinolin-8-amine Traditional Name: (5-nitro-6-o-cumenylsulfonyl-8-quinolyl)amine Formula: C18H17N3O4S MolecularWeight: 371.41028

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=CC=C1S(=O)(=O)C2=C(C3=C(C(=C2)N)N=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CC(C)C1=CC=CC=C1S(=O)(=O)C2=C(C3=C(C(=C2)N)N=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C18H17N3O4S/c1-11(2)12-6-3-4-8-15(12)26(24,25)16-10-14(19)17-13(7-5-9-20-17)18(16)21(22)23/h3-11H,19H2,1-2H3