1-methyl-3-(4-methylphenyl)sulfonyl-6-nitro-spiro[4H-quinoline-2,1'-cyclopentane]-3-carbonitrile

Systemtic Name: 1-methyl-3-(4-methylphenyl)sulfonyl-6-nitro-spiro[4H-quinoline-2,1'-cyclopentane]-3-carbonitrile Openeye Name: 1-methyl-6-nitro-3-(p-tolylsulfonyl)spiro[4H-quinoline-2,1'-cyclopentane]-3-carbonitrile CAS Name: 1-methyl-3-(4-methylphenyl)sulfonyl-6-nitro-3-spiro[4H-quinoline-2,1'-cyclopentane]carbonitrile IUPAC Name: 1-methyl-3-(4-methylphenyl)sulfonyl-6-nitrospiro[4H-quinoline-2,1'-cyclopentane]-3-carbonitrile Traditional Name: 1-methyl-6-nitro-3-tosyl-spiro[4H-quinoline-2,1'-cyclopentane]-3-carbonitrile Formula: C22H23N3O4S MolecularWeight: 425.50072

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)C2(CC3=C(C=CC(=C3)[N+](=O)[O-])N(C24CCCC4)C)C#N

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)C2(CC3=C(C=CC(=C3)[N+](=O)[O-])N(C24CCCC4)C)C#N

InChI

InChI=1S/C22H23N3O4S/c1-16-5-8-19(9-6-16)30(28,29)22(15-23)14-17-13-18(25(26)27)7-10-20(17)24(2)21(22)11-3-4-12-21/h5-10,13H,3-4,11-12,14H2,1-2H3