N-[(1-methylsulfonylpiperidin-4-yl)methyl]-1-(3-nitrophenyl)-N-propyl-propan-2-amine

Systemtic Name: N-[(1-methylsulfonylpiperidin-4-yl)methyl]-1-(3-nitrophenyl)-N-propyl-propan-2-amine Openeye Name: N-[(1-methylsulfonyl-4-piperidyl)methyl]-1-(3-nitrophenyl)-N-propyl-propan-2-amine CAS Name: N-[(1-methylsulfonyl-4-piperidinyl)methyl]-1-(3-nitrophenyl)-N-propyl-2-propanamine IUPAC Name: N-[(1-methylsulfonylpiperidin-4-yl)methyl]-1-(3-nitrophenyl)-N-propylpropan-2-amine Traditional Name: (1-mesyl-4-piperidyl)methyl-[1-methyl-2-(3-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(=CC=C2)[N+](=O)[O-]

Isomeric SMILES

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

InChI

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