N-but-1-ynyl-4-[4-(phenylmethyl)piperidin-1-yl]aniline

Systemtic Name: N-but-1-ynyl-4-[4-(phenylmethyl)piperidin-1-yl]aniline Openeye Name: 4-(4-benzyl-1-piperidyl)-N-but-1-ynyl-aniline CAS Name: N-but-1-ynyl-4-[4-(phenylmethyl)-1-piperidinyl]aniline IUPAC Name: 4-(4-benzylpiperidin-1-yl)-N-but-1-ynylaniline Traditional Name: [4-(4-benzylpiperidino)phenyl]-but-1-ynyl-amine Formula: C22H26N2 MolecularWeight: 318.45524

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Descriptors Computed from Structure

Canonical SMILES:

CCC#CNC1=CC=C(C=C1)N2CCC(CC2)CC3=CC=CC=C3

Isomeric SMILES

CCC#CNC1=CC=C(C=C1)N2CCC(CC2)CC3=CC=CC=C3

InChI

InChI=1S/C22H26N2/c1-2-3-15-23-21-9-11-22(12-10-21)24-16-13-20(14-17-24)18-19-7-5-4-6-8-19/h4-12,20,23H,2,13-14,16-18H2,1H3