4-(3-ethylpiperidin-1-yl)sulfonyl-2-nitro-aniline

Systemtic Name: 4-(3-ethylpiperidin-1-yl)sulfonyl-2-nitro-aniline Openeye Name: 4-[(3-ethyl-1-piperidyl)sulfonyl]-2-nitro-aniline CAS Name: 4-[(3-ethyl-1-piperidinyl)sulfonyl]-2-nitroaniline IUPAC Name: 4-(3-ethylpiperidin-1-yl)sulfonyl-2-nitroaniline Traditional Name: [4-(3-ethylpiperidino)sulfonyl-2-nitro-phenyl]amine Formula: C13H19N3O4S MolecularWeight: 313.37266

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CCCN(C1)S(=O)(=O)C2=CC(=C(C=C2)N)[N+](=O)[O-]

Isomeric SMILES

CCC1CCCN(C1)S(=O)(=O)C2=CC(=C(C=C2)N)[N+](=O)[O-]

InChI

InChI=1S/C13H19N3O4S/c1-2-10-4-3-7-15(9-10)21(19,20)11-5-6-12(14)13(8-11)16(17)18/h5-6,8,10H,2-4,7,9,14H2,1H3