N-[4-[4-(3-chloranyl-2-methyl-phenyl)piperazin-1-yl]butyl]anthracene-2-carboxamide dihydrochloride

Systemtic Name: N-[4-[4-(3-chloranyl-2-methyl-phenyl)piperazin-1-yl]butyl]anthracene-2-carboxamide dihydrochloride Openeye Name: N-[4-[4-(3-chloro-2-methyl-phenyl)piperazin-1-yl]butyl]anthracene-2-carboxamide dihydrochloride CAS Name: N-[4-[4-(3-chloro-2-methylphenyl)-1-piperazinyl]butyl]-2-anthracenecarboxamide dihydrochloride IUPAC Name: N-[4-[4-(3-chloro-2-methylphenyl)piperazin-1-yl]butyl]anthracene-2-carboxamide dihydrochloride Traditional Name: N-[4-[4-(3-chloro-2-methyl-phenyl)piperazino]butyl]anthracene-2-carboxamide dihydrochloride Formula: C30H34Cl3N3O MolecularWeight: 558.96946

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1Cl)N2CCN(CC2)CCCCNC(=O)C3=CC4=CC5=CC=CC=C5C=C4C=C3.Cl.Cl

Isomeric SMILES

CC1=C(C=CC=C1Cl)N2CCN(CC2)CCCCNC(=O)C3=CC4=CC5=CC=CC=C5C=C4C=C3.Cl.Cl

InChI

InChI=1S/C30H32ClN3O.2ClH/c1-22-28(31)9-6-10-29(22)34-17-15-33(16-18-34)14-5-4-13-32-30(35)26-12-11-25-19-23-7-2-3-8-24(23)20-27(25)21-26;;/h2-3,6-12,19-21H,4-5,13-18H2,1H3,(H,32,35);2*1H