N-[(3S)-1-(3-phenylpropyl)piperidin-1-ium-3-yl]cyclohexene-1-carboxamide

Systemtic Name: N-[(3S)-1-(3-phenylpropyl)piperidin-1-ium-3-yl]cyclohexene-1-carboxamide Openeye Name: N-[(3S)-1-(3-phenylpropyl)piperidin-1-ium-3-yl]cyclohexene-1-carboxamide CAS Name: N-[(3S)-1-(3-phenylpropyl)-3-piperidin-1-iumyl]-1-cyclohexenecarboxamide IUPAC Name: N-[(3S)-1-(3-phenylpropyl)piperidin-1-ium-3-yl]cyclohexene-1-carboxamide Traditional Name: N-[(3S)-1-(3-phenylpropyl)piperidin-1-ium-3-yl]cyclohexene-1-carboxamide Formula: C21H31N2O+ MolecularWeight: 327.48364

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(=CC1)C(=O)NC2CCC[NH+](C2)CCCC3=CC=CC=C3

Isomeric SMILES

C1CCC(=CC1)C(=O)N[C@H]2CCC[NH+](C2)CCCC3=CC=CC=C3

InChI

InChI=1S/C21H30N2O/c24-21(19-12-5-2-6-13-19)22-20-14-8-16-23(17-20)15-7-11-18-9-3-1-4-10-18/h1,3-4,9-10,12,20H,2,5-8,11,13-17H2,(H,22,24)/p+1/t20-/m0/s1