[1-(2-methyl-3-nitro-phenyl)sulfonylpiperidin-4-yl]methanamine

Systemtic Name: [1-(2-methyl-3-nitro-phenyl)sulfonylpiperidin-4-yl]methanamine Openeye Name: [1-(2-methyl-3-nitro-phenyl)sulfonyl-4-piperidyl]methanamine CAS Name: [1-(2-methyl-3-nitrophenyl)sulfonyl-4-piperidinyl]methanamine IUPAC Name: [1-(2-methyl-3-nitrophenyl)sulfonylpiperidin-4-yl]methanamine Traditional Name: [1-(2-methyl-3-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=C1S(=O)(=O)N2CCC(CC2)CN)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=CC=C1S(=O)(=O)N2CCC(CC2)CN)[N+](=O)[O-]

InChI

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