N-[(S)-(4-methoxyphenyl)-phenyl-methyl]-2-[(3S)-3-methylpiperidin-1-ium-1-yl]ethanamide

Systemtic Name: N-[(S)-(4-methoxyphenyl)-phenyl-methyl]-2-[(3S)-3-methylpiperidin-1-ium-1-yl]ethanamide Openeye Name: N-[(S)-(4-methoxyphenyl)-phenyl-methyl]-2-[(3S)-3-methylpiperidin-1-ium-1-yl]acetamide CAS Name: N-[(S)-(4-methoxyphenyl)-phenylmethyl]-2-[(3S)-3-methyl-1-piperidin-1-iumyl]acetamide IUPAC Name: N-[(S)-(4-methoxyphenyl)-phenylmethyl]-2-[(3S)-3-methylpiperidin-1-ium-1-yl]acetamide Traditional Name: N-[(S)-(4-methoxyphenyl)-phenyl-methyl]-2-[(3S)-3-methylpiperidin-1-ium-1-yl]acetamide Formula: C22H29N2O2+ MolecularWeight: 353.47786

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC[NH+](C1)CC(=O)NC(C2=CC=CC=C2)C3=CC=C(C=C3)OC

Isomeric SMILES

C[C@H]1CCC[NH+](C1)CC(=O)N[C@@H](C2=CC=CC=C2)C3=CC=C(C=C3)OC

InChI

InChI=1S/C22H28N2O2/c1-17-7-6-14-24(15-17)16-21(25)23-22(18-8-4-3-5-9-18)19-10-12-20(26-2)13-11-19/h3-5,8-13,17,22H,6-7,14-16H2,1-2H3,(H,23,25)/p+1/t17-,22-/m0/s1