N3-cyclopropyl-N1-(2-nitro-4-piperidin-1-ylsulfonyl-phenyl)benzene-1,3-diamine

Systemtic Name: N3-cyclopropyl-N1-(2-nitro-4-piperidin-1-ylsulfonyl-phenyl)benzene-1,3-diamine Openeye Name: N3-cyclopropyl-N1-[2-nitro-4-(1-piperidylsulfonyl)phenyl]benzene-1,3-diamine CAS Name: N3-cyclopropyl-N1-[2-nitro-4-(1-piperidinylsulfonyl)phenyl]benzene-1,3-diamine IUPAC Name: 3-N-cyclopropyl-1-N-(2-nitro-4-piperidin-1-ylsulfonylphenyl)benzene-1,3-diamine Traditional Name: cyclopropyl-[3-(2-nitro-4-piperidinosulfonyl-anilino)phenyl]amine Formula: C20H24N4O4S MolecularWeight: 416.49396

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)NC3=CC(=CC=C3)NC4CC4)[N+](=O)[O-]

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)NC3=CC(=CC=C3)NC4CC4)[N+](=O)[O-]

InChI

InChI=1S/C20H24N4O4S/c25-24(26)20-14-18(29(27,28)23-11-2-1-3-12-23)9-10-19(20)22-17-6-4-5-16(13-17)21-15-7-8-15/h4-6,9-10,13-15,21-22H,1-3,7-8,11-12H2