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N-[(3S)-1-(cyclohexylmethyl)piperidin-1-ium-3-yl]-3-methyl-benzamide

N-[(3S)-1-(cyclohexylmethyl)piperidin-1-ium-3-yl]-3-methyl-benzamide

Systemtic Name:N-[(3S)-1-(cyclohexylmethyl)piperidin-1-ium-3-yl]-3-methyl-benzamide
Openeye Name:N-[(3S)-1-(cyclohexylmethyl)piperidin-1-ium-3-yl]-3-methyl-benzamide
CAS Name:N-[(3S)-1-(cyclohexylmethyl)-3-piperidin-1-iumyl]-3-methylbenzamide
IUPAC Name:N-[(3S)-1-(cyclohexylmethyl)piperidin-1-ium-3-yl]-3-methylbenzamide
Traditional Name:N-[(3S)-1-(cyclohexylmethyl)piperidin-1-ium-3-yl]-3-methyl-benzamide
Formula: C20H31N2O+
MolecularWeight: 315.47294
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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C(=O)NC2CCC[NH+](C2)CC3CCCCC3


Isomeric SMILES

CC1=CC=CC(=C1)C(=O)N[C@H]2CCC[NH+](C2)CC3CCCCC3


InChI

InChI=1S/C20H30N2O/c1-16-7-5-10-18(13-16)20(23)21-19-11-6-12-22(15-19)14-17-8-3-2-4-9-17/h5,7,10,13,17,19H,2-4,6,8-9,11-12,14-15H2,1H3,(H,21,23)/p+1/t19-/m0/s1


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