2-[4-[[4-chloranyl-3-(2-methylphenyl)phenyl]methoxymethyl]phenyl]-1-ethyl-piperazine

Systemtic Name: 2-[4-[[4-chloranyl-3-(2-methylphenyl)phenyl]methoxymethyl]phenyl]-1-ethyl-piperazine Openeye Name: 2-[4-[[4-chloro-3-(o-tolyl)phenyl]methoxymethyl]phenyl]-1-ethyl-piperazine CAS Name: 2-[4-[[4-chloro-3-(2-methylphenyl)phenyl]methoxymethyl]phenyl]-1-ethylpiperazine IUPAC Name: 2-[4-[[4-chloro-3-(2-methylphenyl)phenyl]methoxymethyl]phenyl]-1-ethylpiperazine Traditional Name: 2-[4-[[4-chloro-3-(o-tolyl)benzyl]oxymethyl]phenyl]-1-ethyl-piperazine Formula: C27H31ClN2O MolecularWeight: 435.00084

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCNCC1C2=CC=C(C=C2)COCC3=CC(=C(C=C3)Cl)C4=CC=CC=C4C

Isomeric SMILES

CCN1CCNCC1C2=CC=C(C=C2)COCC3=CC(=C(C=C3)Cl)C4=CC=CC=C4C

InChI

InChI=1S/C27H31ClN2O/c1-3-30-15-14-29-17-27(30)23-11-8-21(9-12-23)18-31-19-22-10-13-26(28)25(16-22)24-7-5-4-6-20(24)2/h4-13,16,27,29H,3,14-15,17-19H2,1-2H3