N-[(2R)-2-(4-methoxyphenyl)-2-morpholin-4-ium-4-yl-ethyl]-2-(phenylcarbonyl)benzamide

Systemtic Name: N-[(2R)-2-(4-methoxyphenyl)-2-morpholin-4-ium-4-yl-ethyl]-2-(phenylcarbonyl)benzamide Openeye Name: 2-benzoyl-N-[(2R)-2-(4-methoxyphenyl)-2-morpholin-4-ium-4-yl-ethyl]benzamide CAS Name: 2-benzoyl-N-[(2R)-2-(4-methoxyphenyl)-2-(4-morpholin-4-iumyl)ethyl]benzamide IUPAC Name: 2-benzoyl-N-[(2R)-2-(4-methoxyphenyl)-2-morpholin-4-ium-4-ylethyl]benzamide Traditional Name: 2-benzoyl-N-[(2R)-2-(4-methoxyphenyl)-2-morpholin-4-ium-4-yl-ethyl]benzamide Formula: C27H29N2O4+ MolecularWeight: 445.53016

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(CNC(=O)C2=CC=CC=C2C(=O)C3=CC=CC=C3)[NH+]4CCOCC4

Isomeric SMILES

COC1=CC=C(C=C1)[C@H](CNC(=O)C2=CC=CC=C2C(=O)C3=CC=CC=C3)[NH+]4CCOCC4

InChI

InChI=1S/C27H28N2O4/c1-32-22-13-11-20(12-14-22)25(29-15-17-33-18-16-29)19-28-27(31)24-10-6-5-9-23(24)26(30)21-7-3-2-4-8-21/h2-14,25H,15-19H2,1H3,(H,28,31)/p+1/t25-/m0/s1