4-[3-[4-[(4-methylphenyl)methyl]piperidin-1-yl]prop-1-ynyl]benzene-1,2-diamine

Systemtic Name: 4-[3-[4-[(4-methylphenyl)methyl]piperidin-1-yl]prop-1-ynyl]benzene-1,2-diamine Openeye Name: 4-[3-[4-(p-tolylmethyl)-1-piperidyl]prop-1-ynyl]benzene-1,2-diamine CAS Name: 4-[3-[4-[(4-methylphenyl)methyl]-1-piperidinyl]prop-1-ynyl]benzene-1,2-diamine IUPAC Name: 4-[3-[4-[(4-methylphenyl)methyl]piperidin-1-yl]prop-1-ynyl]benzene-1,2-diamine Traditional Name: [2-amino-4-[3-[4-(4-methylbenzyl)piperidino]prop-1-ynyl]phenyl]amine Formula: C22H27N3 MolecularWeight: 333.46988

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CC2CCN(CC2)CC#CC3=CC(=C(C=C3)N)N

Isomeric SMILES

CC1=CC=C(C=C1)CC2CCN(CC2)CC#CC3=CC(=C(C=C3)N)N

InChI

InChI=1S/C22H27N3/c1-17-4-6-19(7-5-17)15-20-10-13-25(14-11-20)12-2-3-18-8-9-21(23)22(24)16-18/h4-9,16,20H,10-15,23-24H2,1H3