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

Systemtic Name: 4-[3-[4-[(4-chlorophenyl)methyl]piperidin-1-yl]prop-1-ynyl]benzene-1,2-diamine Openeye Name: 4-[3-[4-[(4-chlorophenyl)methyl]-1-piperidyl]prop-1-ynyl]benzene-1,2-diamine CAS Name: 4-[3-[4-[(4-chlorophenyl)methyl]-1-piperidinyl]prop-1-ynyl]benzene-1,2-diamine IUPAC Name: 4-[3-[4-[(4-chlorophenyl)methyl]piperidin-1-yl]prop-1-ynyl]benzene-1,2-diamine Traditional Name: [2-amino-4-[3-[4-(4-chlorobenzyl)piperidino]prop-1-ynyl]phenyl]amine Formula: C21H24ClN3 MolecularWeight: 353.88836

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CC2=CC=C(C=C2)Cl)CC#CC3=CC(=C(C=C3)N)N

Isomeric SMILES

C1CN(CCC1CC2=CC=C(C=C2)Cl)CC#CC3=CC(=C(C=C3)N)N

InChI

InChI=1S/C21H24ClN3/c22-19-6-3-17(4-7-19)14-18-9-12-25(13-10-18)11-1-2-16-5-8-20(23)21(24)15-16/h3-8,15,18H,9-14,23-24H2