5-chloranyl-5-[3-[4-(phenylmethyl)piperidin-1-yl]propyl]cyclohexa-1,3-dien-1-amine

Systemtic Name: 5-chloranyl-5-[3-[4-(phenylmethyl)piperidin-1-yl]propyl]cyclohexa-1,3-dien-1-amine Openeye Name: 5-[3-(4-benzyl-1-piperidyl)propyl]-5-chloro-cyclohexa-1,3-dien-1-amine CAS Name: 5-chloro-5-[3-[4-(phenylmethyl)-1-piperidinyl]propyl]-1-cyclohexa-1,3-dienamine IUPAC Name: 5-[3-(4-benzylpiperidin-1-yl)propyl]-5-chlorocyclohexa-1,3-dien-1-amine Traditional Name: [5-[3-(4-benzylpiperidino)propyl]-5-chloro-cyclohexa-1,3-dien-1-yl]amine Formula: C21H29ClN2 MolecularWeight: 344.92136

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CC2=CC=CC=C2)CCCC3(CC(=CC=C3)N)Cl

Isomeric SMILES

C1CN(CCC1CC2=CC=CC=C2)CCCC3(CC(=CC=C3)N)Cl

InChI

InChI=1S/C21H29ClN2/c22-21(11-4-8-20(23)17-21)12-5-13-24-14-9-19(10-15-24)16-18-6-2-1-3-7-18/h1-4,6-8,11,19H,5,9-10,12-17,23H2