N-ethyl-4-(4-methylpiperidin-1-yl)sulfonyl-2-nitro-aniline

Systemtic Name: N-ethyl-4-(4-methylpiperidin-1-yl)sulfonyl-2-nitro-aniline Openeye Name: N-ethyl-4-[(4-methyl-1-piperidyl)sulfonyl]-2-nitro-aniline CAS Name: N-ethyl-4-[(4-methyl-1-piperidinyl)sulfonyl]-2-nitroaniline IUPAC Name: N-ethyl-4-(4-methylpiperidin-1-yl)sulfonyl-2-nitroaniline Traditional Name: ethyl-[4-(4-methylpiperidino)sulfonyl-2-nitro-phenyl]amine Formula: C14H21N3O4S MolecularWeight: 327.39924

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Descriptors Computed from Structure

Canonical SMILES:

CCNC1=C(C=C(C=C1)S(=O)(=O)N2CCC(CC2)C)[N+](=O)[O-]

Isomeric SMILES

CCNC1=C(C=C(C=C1)S(=O)(=O)N2CCC(CC2)C)[N+](=O)[O-]

InChI

InChI=1S/C14H21N3O4S/c1-3-15-13-5-4-12(10-14(13)17(18)19)22(20,21)16-8-6-11(2)7-9-16/h4-5,10-11,15H,3,6-9H2,1-2H3