N-[(1-methylsulfonylpiperidin-4-yl)methyl]-1-(4-nitrophenyl)-N-propyl-propan-2-amine

Systemtic Name: N-[(1-methylsulfonylpiperidin-4-yl)methyl]-1-(4-nitrophenyl)-N-propyl-propan-2-amine Openeye Name: N-[(1-methylsulfonyl-4-piperidyl)methyl]-1-(4-nitrophenyl)-N-propyl-propan-2-amine CAS Name: N-[(1-methylsulfonyl-4-piperidinyl)methyl]-1-(4-nitrophenyl)-N-propyl-2-propanamine IUPAC Name: N-[(1-methylsulfonylpiperidin-4-yl)methyl]-1-(4-nitrophenyl)-N-propylpropan-2-amine Traditional Name: (1-mesyl-4-piperidyl)methyl-[1-methyl-2-(4-nitrophenyl)ethyl]-propyl-amine Formula: C19H31N3O4S MolecularWeight: 397.53214

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CC1CCN(CC1)S(=O)(=O)C)C(C)CC2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CCCN(CC1CCN(CC1)S(=O)(=O)C)C(C)CC2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C19H31N3O4S/c1-4-11-20(15-18-9-12-21(13-10-18)27(3,25)26)16(2)14-17-5-7-19(8-6-17)22(23)24/h5-8,16,18H,4,9-15H2,1-3H3