N-[3-[4-[(4-methylsulfonylphenyl)methyl]piperidin-1-yl]propyl]-4-propyl-aniline

Systemtic Name: N-[3-[4-[(4-methylsulfonylphenyl)methyl]piperidin-1-yl]propyl]-4-propyl-aniline Openeye Name: N-[3-[4-[(4-methylsulfonylphenyl)methyl]-1-piperidyl]propyl]-4-propyl-aniline CAS Name: N-[3-[4-[(4-methylsulfonylphenyl)methyl]-1-piperidinyl]propyl]-4-propylaniline IUPAC Name: N-[3-[4-[(4-methylsulfonylphenyl)methyl]piperidin-1-yl]propyl]-4-propylaniline Traditional Name: 3-[4-(4-mesylbenzyl)piperidino]propyl-(4-propylphenyl)amine Formula: C25H36N2O2S MolecularWeight: 428.63054

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC=C(C=C1)NCCCN2CCC(CC2)CC3=CC=C(C=C3)S(=O)(=O)C

Isomeric SMILES

CCCC1=CC=C(C=C1)NCCCN2CCC(CC2)CC3=CC=C(C=C3)S(=O)(=O)C

InChI

InChI=1S/C25H36N2O2S/c1-3-5-21-6-10-24(11-7-21)26-16-4-17-27-18-14-23(15-19-27)20-22-8-12-25(13-9-22)30(2,28)29/h6-13,23,26H,3-5,14-20H2,1-2H3