2-azanyl-5-[2-[bis(4-chlorophenyl)methyl]piperazin-1-yl]-4-methyl-3-propyl-phenol

Systemtic Name: 2-azanyl-5-[2-[bis(4-chlorophenyl)methyl]piperazin-1-yl]-4-methyl-3-propyl-phenol Openeye Name: 2-amino-5-[2-[bis(4-chlorophenyl)methyl]piperazin-1-yl]-4-methyl-3-propyl-phenol CAS Name: 2-amino-5-[2-[bis(4-chlorophenyl)methyl]-1-piperazinyl]-4-methyl-3-propylphenol IUPAC Name: 2-amino-5-[2-[bis(4-chlorophenyl)methyl]piperazin-1-yl]-4-methyl-3-propylphenol Traditional Name: 2-amino-5-[2-[bis(4-chlorophenyl)methyl]piperazino]-4-methyl-3-propyl-phenol Formula: C27H31Cl2N3O MolecularWeight: 484.46054

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C(=CC(=C1N)O)N2CCNCC2C(C3=CC=C(C=C3)Cl)C4=CC=C(C=C4)Cl)C

Isomeric SMILES

CCCC1=C(C(=CC(=C1N)O)N2CCNCC2C(C3=CC=C(C=C3)Cl)C4=CC=C(C=C4)Cl)C

InChI

InChI=1S/C27H31Cl2N3O/c1-3-4-22-17(2)23(15-25(33)27(22)30)32-14-13-31-16-24(32)26(18-5-9-20(28)10-6-18)19-7-11-21(29)12-8-19/h5-12,15,24,26,31,33H,3-4,13-14,16,30H2,1-2H3