N-(4-ethoxyphenyl)-2-[2-[(2S)-2-methylpiperidin-1-ium-1-yl]ethanoylamino]benzamide

Systemtic Name: N-(4-ethoxyphenyl)-2-[2-[(2S)-2-methylpiperidin-1-ium-1-yl]ethanoylamino]benzamide Openeye Name: N-(4-ethoxyphenyl)-2-[[2-[(2S)-2-methylpiperidin-1-ium-1-yl]acetyl]amino]benzamide CAS Name: N-(4-ethoxyphenyl)-2-[[2-[(2S)-2-methyl-1-piperidin-1-iumyl]-1-oxoethyl]amino]benzamide IUPAC Name: N-(4-ethoxyphenyl)-2-[[2-[(2S)-2-methylpiperidin-1-ium-1-yl]acetyl]amino]benzamide Traditional Name: 2-[[2-[(2S)-2-methylpiperidin-1-ium-1-yl]acetyl]amino]-N-p-phenetyl-benzamide Formula: C23H30N3O3+ MolecularWeight: 396.5026

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)NC(=O)C2=CC=CC=C2NC(=O)C[NH+]3CCCCC3C

Isomeric SMILES

CCOC1=CC=C(C=C1)NC(=O)C2=CC=CC=C2NC(=O)C[NH+]3CCCC[C@@H]3C

InChI

InChI=1S/C23H29N3O3/c1-3-29-19-13-11-18(12-14-19)24-23(28)20-9-4-5-10-21(20)25-22(27)16-26-15-7-6-8-17(26)2/h4-5,9-14,17H,3,6-8,15-16H2,1-2H3,(H,24,28)(H,25,27)/p+1/t17-/m0/s1