N-[1-[4-[(3,4-dichlorophenyl)methyl]-1-methyl-piperidin-1-ium-1-yl]-3-methyl-butan-2-yl]-4-methyl-benzamide

Systemtic Name: N-[1-[4-[(3,4-dichlorophenyl)methyl]-1-methyl-piperidin-1-ium-1-yl]-3-methyl-butan-2-yl]-4-methyl-benzamide Openeye Name: N-[1-[[4-[(3,4-dichlorophenyl)methyl]-1-methyl-piperidin-1-ium-1-yl]methyl]-2-methyl-propyl]-4-methyl-benzamide CAS Name: N-[1-[4-[(3,4-dichlorophenyl)methyl]-1-methyl-1-piperidin-1-iumyl]-3-methylbutan-2-yl]-4-methylbenzamide IUPAC Name: N-[1-[4-[(3,4-dichlorophenyl)methyl]-1-methylpiperidin-1-ium-1-yl]-3-methylbutan-2-yl]-4-methylbenzamide Traditional Name: N-[1-[[4-(3,4-dichlorobenzyl)-1-methyl-piperidin-1-ium-1-yl]methyl]-2-methyl-propyl]-4-methyl-benzamide Formula: C26H35Cl2N2O+ MolecularWeight: 462.4749

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)NC(C[N+]2(CCC(CC2)CC3=CC(=C(C=C3)Cl)Cl)C)C(C)C

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)NC(C[N+]2(CCC(CC2)CC3=CC(=C(C=C3)Cl)Cl)C)C(C)C

InChI

InChI=1S/C26H34Cl2N2O/c1-18(2)25(29-26(31)22-8-5-19(3)6-9-22)17-30(4)13-11-20(12-14-30)15-21-7-10-23(27)24(28)16-21/h5-10,16,18,20,25H,11-15,17H2,1-4H3/p+1