2-[3-[4-[bis(4-chlorophenyl)methyl]piperazin-1-yl]propylamino]-4-methyl-phenol

Systemtic Name: 2-[3-[4-[bis(4-chlorophenyl)methyl]piperazin-1-yl]propylamino]-4-methyl-phenol Openeye Name: 2-[3-[4-[bis(4-chlorophenyl)methyl]piperazin-1-yl]propylamino]-4-methyl-phenol CAS Name: 2-[3-[4-[bis(4-chlorophenyl)methyl]-1-piperazinyl]propylamino]-4-methylphenol IUPAC Name: 2-[3-[4-[bis(4-chlorophenyl)methyl]piperazin-1-yl]propylamino]-4-methylphenol Traditional Name: 2-[3-[4-[bis(4-chlorophenyl)methyl]piperazino]propylamino]-4-methyl-phenol Formula: C27H31Cl2N3O MolecularWeight: 484.46054

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)O)NCCCN2CCN(CC2)C(C3=CC=C(C=C3)Cl)C4=CC=C(C=C4)Cl

Isomeric SMILES

CC1=CC(=C(C=C1)O)NCCCN2CCN(CC2)C(C3=CC=C(C=C3)Cl)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C27H31Cl2N3O/c1-20-3-12-26(33)25(19-20)30-13-2-14-31-15-17-32(18-16-31)27(21-4-8-23(28)9-5-21)22-6-10-24(29)11-7-22/h3-12,19,27,30,33H,2,13-18H2,1H3