[1-(2-methyl-4-nitro-phenyl)sulfonylpiperidin-4-yl]methanamine

Systemtic Name: [1-(2-methyl-4-nitro-phenyl)sulfonylpiperidin-4-yl]methanamine Openeye Name: [1-(2-methyl-4-nitro-phenyl)sulfonyl-4-piperidyl]methanamine CAS Name: [1-(2-methyl-4-nitrophenyl)sulfonyl-4-piperidinyl]methanamine IUPAC Name: [1-(2-methyl-4-nitrophenyl)sulfonylpiperidin-4-yl]methanamine Traditional Name: [1-(2-methyl-4-nitro-phenyl)sulfonyl-4-piperidyl]methylamine Formula: C13H19N3O4S MolecularWeight: 313.37266

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)[N+](=O)[O-])S(=O)(=O)N2CCC(CC2)CN

Isomeric SMILES

CC1=C(C=CC(=C1)[N+](=O)[O-])S(=O)(=O)N2CCC(CC2)CN

InChI

InChI=1S/C13H19N3O4S/c1-10-8-12(16(17)18)2-3-13(10)21(19,20)15-6-4-11(9-14)5-7-15/h2-3,8,11H,4-7,9,14H2,1H3