1,7-bis[4-(4-chlorophenyl)-4-oxidanyl-piperidin-1-yl]-3,5-bis(4-dimethylaminophenyl)heptan-4-one

Systemtic Name: 1,7-bis[4-(4-chlorophenyl)-4-oxidanyl-piperidin-1-yl]-3,5-bis(4-dimethylaminophenyl)heptan-4-one Openeye Name: 1,7-bis[4-(4-chlorophenyl)-4-hydroxy-1-piperidyl]-3,5-bis(4-dimethylaminophenyl)heptan-4-one CAS Name: 1,7-bis[4-(4-chlorophenyl)-4-hydroxy-1-piperidinyl]-3,5-bis(4-dimethylaminophenyl)-4-heptanone IUPAC Name: 1,7-bis[4-(4-chlorophenyl)-4-hydroxypiperidin-1-yl]-3,5-bis(4-dimethylaminophenyl)heptan-4-one Traditional Name: 1,7-bis[4-(4-chlorophenyl)-4-hydroxy-piperidino]-3,5-bis(4-dimethylaminophenyl)heptan-4-one Formula: C45H56Cl2N4O3 MolecularWeight: 771.85714

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=C(C=C1)C(CCN2CCC(CC2)(C3=CC=C(C=C3)Cl)O)C(=O)C(CCN4CCC(CC4)(C5=CC=C(C=C5)Cl)O)C6=CC=C(C=C6)N(C)C

Isomeric SMILES

CN(C)C1=CC=C(C=C1)C(CCN2CCC(CC2)(C3=CC=C(C=C3)Cl)O)C(=O)C(CCN4CCC(CC4)(C5=CC=C(C=C5)Cl)O)C6=CC=C(C=C6)N(C)C

InChI

InChI=1S/C45H56Cl2N4O3/c1-48(2)39-17-5-33(6-18-39)41(21-27-50-29-23-44(53,24-30-50)35-9-13-37(46)14-10-35)43(52)42(34-7-19-40(20-8-34)49(3)4)22-28-51-31-25-45(54,26-32-51)36-11-15-38(47)16-12-36/h5-20,41-42,53-54H,21-32H2,1-4H3