N-[4-[4-[4-(2-methoxyethyl)piperazin-1-ium-1-yl]piperidin-1-yl]phenyl]-2,4-dimethyl-benzamide

Systemtic Name: N-[4-[4-[4-(2-methoxyethyl)piperazin-1-ium-1-yl]piperidin-1-yl]phenyl]-2,4-dimethyl-benzamide Openeye Name: N-[4-[4-[4-(2-methoxyethyl)piperazin-1-ium-1-yl]-1-piperidyl]phenyl]-2,4-dimethyl-benzamide CAS Name: N-[4-[4-[4-(2-methoxyethyl)-1-piperazin-1-iumyl]-1-piperidinyl]phenyl]-2,4-dimethylbenzamide IUPAC Name: N-[4-[4-[4-(2-methoxyethyl)piperazin-1-ium-1-yl]piperidin-1-yl]phenyl]-2,4-dimethylbenzamide Traditional Name: N-[4-[4-[4-(2-methoxyethyl)piperazin-1-ium-1-yl]piperidino]phenyl]-2,4-dimethyl-benzamide Formula: C27H39N4O2+ MolecularWeight: 451.62416

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C(=O)NC2=CC=C(C=C2)N3CCC(CC3)[NH+]4CCN(CC4)CCOC)C

Isomeric SMILES

CC1=CC(=C(C=C1)C(=O)NC2=CC=C(C=C2)N3CCC(CC3)[NH+]4CCN(CC4)CCOC)C

InChI

InChI=1S/C27H38N4O2/c1-21-4-9-26(22(2)20-21)27(32)28-23-5-7-24(8-6-23)30-12-10-25(11-13-30)31-16-14-29(15-17-31)18-19-33-3/h4-9,20,25H,10-19H2,1-3H3,(H,28,32)/p+1