4-methyl-N-[(2R)-4-methyl-1-oxidanylidene-1-[[1-(phenylmethyl)piperidin-1-ium-4-yl]amino]pentan-2-yl]cyclohexane-1-carboxamide

Systemtic Name: 4-methyl-N-[(2R)-4-methyl-1-oxidanylidene-1-[[1-(phenylmethyl)piperidin-1-ium-4-yl]amino]pentan-2-yl]cyclohexane-1-carboxamide Openeye Name: N-[(1R)-1-[(1-benzylpiperidin-1-ium-4-yl)carbamoyl]-3-methyl-butyl]-4-methyl-cyclohexanecarboxamide CAS Name: 4-methyl-N-[(2R)-4-methyl-1-oxo-1-[[1-(phenylmethyl)-4-piperidin-1-iumyl]amino]pentan-2-yl]-1-cyclohexanecarboxamide IUPAC Name: N-[(2R)-1-[(1-benzylpiperidin-1-ium-4-yl)amino]-4-methyl-1-oxopentan-2-yl]-4-methylcyclohexane-1-carboxamide Traditional Name: N-[(1R)-1-[(1-benzylpiperidin-1-ium-4-yl)carbamoyl]-3-methyl-butyl]-4-methyl-cyclohexanecarboxamide Formula: C26H42N3O2+ MolecularWeight: 428.63058

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(CC1)C(=O)NC(CC(C)C)C(=O)NC2CC[NH+](CC2)CC3=CC=CC=C3

Isomeric SMILES

CC1CCC(CC1)C(=O)N[C@H](CC(C)C)C(=O)NC2CC[NH+](CC2)CC3=CC=CC=C3

InChI

InChI=1S/C26H41N3O2/c1-19(2)17-24(28-25(30)22-11-9-20(3)10-12-22)26(31)27-23-13-15-29(16-14-23)18-21-7-5-4-6-8-21/h4-8,19-20,22-24H,9-18H2,1-3H3,(H,27,31)(H,28,30)/p+1/t20?,22?,24-/m1/s1