4-[3-[4-(phenylmethyl)piperidin-1-yl]prop-1-ynyl]aniline

Systemtic Name: 4-[3-[4-(phenylmethyl)piperidin-1-yl]prop-1-ynyl]aniline Openeye Name: 4-[3-(4-benzyl-1-piperidyl)prop-1-ynyl]aniline CAS Name: 4-[3-[4-(phenylmethyl)-1-piperidinyl]prop-1-ynyl]aniline IUPAC Name: 4-[3-(4-benzylpiperidin-1-yl)prop-1-ynyl]aniline Traditional Name: [4-[3-(4-benzylpiperidino)prop-1-ynyl]phenyl]amine Formula: C21H24N2 MolecularWeight: 304.42866

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H24N2/c22-21-10-8-18(9-11-21)7-4-14-23-15-12-20(13-16-23)17-19-5-2-1-3-6-19/h1-3,5-6,8-11,20H,12-17,22H2