4-methyl-N-[(2R)-3-methyl-1-oxidanylidene-1-[4-(phenylmethyl)piperazin-4-ium-1-yl]butan-2-yl]cyclohexane-1-carboxamide

Systemtic Name: 4-methyl-N-[(2R)-3-methyl-1-oxidanylidene-1-[4-(phenylmethyl)piperazin-4-ium-1-yl]butan-2-yl]cyclohexane-1-carboxamide Openeye Name: N-[(1R)-1-(4-benzylpiperazin-4-ium-1-carbonyl)-2-methyl-propyl]-4-methyl-cyclohexanecarboxamide CAS Name: 4-methyl-N-[(2R)-3-methyl-1-oxo-1-[4-(phenylmethyl)-1-piperazin-4-iumyl]butan-2-yl]-1-cyclohexanecarboxamide IUPAC Name: N-[(2R)-1-(4-benzylpiperazin-4-ium-1-yl)-3-methyl-1-oxobutan-2-yl]-4-methylcyclohexane-1-carboxamide Traditional Name: N-[(1R)-1-(4-benzylpiperazin-4-ium-1-carbonyl)-2-methyl-propyl]-4-methyl-cyclohexanecarboxamide Formula: C24H38N3O2+ MolecularWeight: 400.57742

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(CC1)C(=O)NC(C(C)C)C(=O)N2CC[NH+](CC2)CC3=CC=CC=C3

Isomeric SMILES

CC1CCC(CC1)C(=O)N[C@H](C(C)C)C(=O)N2CC[NH+](CC2)CC3=CC=CC=C3

InChI

InChI=1S/C24H37N3O2/c1-18(2)22(25-23(28)21-11-9-19(3)10-12-21)24(29)27-15-13-26(14-16-27)17-20-7-5-4-6-8-20/h4-8,18-19,21-22H,9-17H2,1-3H3,(H,25,28)/p+1/t19?,21?,22-/m1/s1