N,N-diethyl-4-[3-methyl-2-[(4-prop-2-enylpiperazin-1-yl)methyl]phenyl]benzamide dihydrochloride

Systemtic Name: N,N-diethyl-4-[3-methyl-2-[(4-prop-2-enylpiperazin-1-yl)methyl]phenyl]benzamide dihydrochloride Openeye Name: 4-[2-[(4-allylpiperazin-1-yl)methyl]-3-methyl-phenyl]-N,N-diethyl-benzamide dihydrochloride CAS Name: N,N-diethyl-4-[3-methyl-2-[(4-prop-2-enyl-1-piperazinyl)methyl]phenyl]benzamide dihydrochloride IUPAC Name: N,N-diethyl-4-[3-methyl-2-[(4-prop-2-enylpiperazin-1-yl)methyl]phenyl]benzamide dihydrochloride Traditional Name: 4-[2-[(4-allylpiperazino)methyl]-3-methyl-phenyl]-N,N-diethyl-benzamide dihydrochloride Formula: C26H37Cl2N3O MolecularWeight: 478.49748

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)C1=CC=C(C=C1)C2=C(C(=CC=C2)C)CN3CCN(CC3)CC=C.Cl.Cl

Isomeric SMILES

CCN(CC)C(=O)C1=CC=C(C=C1)C2=C(C(=CC=C2)C)CN3CCN(CC3)CC=C.Cl.Cl

InChI

InChI=1S/C26H35N3O.2ClH/c1-5-15-27-16-18-28(19-17-27)20-25-21(4)9-8-10-24(25)22-11-13-23(14-12-22)26(30)29(6-2)7-3;;/h5,8-14H,1,6-7,15-20H2,2-4H3;2*1H