N-[(1S)-1-(4-ethoxyphenyl)ethyl]-4-(piperidin-1-ium-1-ylmethyl)benzamide

Systemtic Name: N-[(1S)-1-(4-ethoxyphenyl)ethyl]-4-(piperidin-1-ium-1-ylmethyl)benzamide Openeye Name: N-[(1S)-1-(4-ethoxyphenyl)ethyl]-4-(piperidin-1-ium-1-ylmethyl)benzamide CAS Name: N-[(1S)-1-(4-ethoxyphenyl)ethyl]-4-(1-piperidin-1-iumylmethyl)benzamide IUPAC Name: N-[(1S)-1-(4-ethoxyphenyl)ethyl]-4-(piperidin-1-ium-1-ylmethyl)benzamide Traditional Name: 4-(piperidin-1-ium-1-ylmethyl)-N-[(1S)-1-p-phenetylethyl]benzamide Formula: C23H31N2O2+ MolecularWeight: 367.50444

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C(C)NC(=O)C2=CC=C(C=C2)C[NH+]3CCCCC3

Isomeric SMILES

CCOC1=CC=C(C=C1)[C@H](C)NC(=O)C2=CC=C(C=C2)C[NH+]3CCCCC3

InChI

InChI=1S/C23H30N2O2/c1-3-27-22-13-11-20(12-14-22)18(2)24-23(26)21-9-7-19(8-10-21)17-25-15-5-4-6-16-25/h7-14,18H,3-6,15-17H2,1-2H3,(H,24,26)/p+1/t18-/m0/s1