4-[(2-methyl-3-piperidin-1-yl-propyl)amino]-3-nitro-N-propan-2-yl-benzenesulfonamide

Systemtic Name: 4-[(2-methyl-3-piperidin-1-yl-propyl)amino]-3-nitro-N-propan-2-yl-benzenesulfonamide Openeye Name: N-isopropyl-4-[[2-methyl-3-(1-piperidyl)propyl]amino]-3-nitro-benzenesulfonamide CAS Name: 4-[[2-methyl-3-(1-piperidinyl)propyl]amino]-3-nitro-N-propan-2-ylbenzenesulfonamide IUPAC Name: 4-[(2-methyl-3-piperidin-1-ylpropyl)amino]-3-nitro-N-propan-2-ylbenzenesulfonamide Traditional Name: N-isopropyl-4-[(2-methyl-3-piperidino-propyl)amino]-3-nitro-benzenesulfonamide Formula: C18H30N4O4S MolecularWeight: 398.5202

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NS(=O)(=O)C1=CC(=C(C=C1)NCC(C)CN2CCCCC2)[N+](=O)[O-]

Isomeric SMILES

CC(C)NS(=O)(=O)C1=CC(=C(C=C1)NCC(C)CN2CCCCC2)[N+](=O)[O-]

InChI

InChI=1S/C18H30N4O4S/c1-14(2)20-27(25,26)16-7-8-17(18(11-16)22(23)24)19-12-15(3)13-21-9-5-4-6-10-21/h7-8,11,14-15,19-20H,4-6,9-10,12-13H2,1-3H3