(2S)-N-(3-chloranyl-2-methyl-phenyl)-2-(4-morpholin-4-ylcarbonylpiperidin-1-ium-1-yl)propanamide

Systemtic Name: (2S)-N-(3-chloranyl-2-methyl-phenyl)-2-(4-morpholin-4-ylcarbonylpiperidin-1-ium-1-yl)propanamide Openeye Name: (2S)-N-(3-chloro-2-methyl-phenyl)-2-[4-(morpholine-4-carbonyl)piperidin-1-ium-1-yl]propanamide CAS Name: (2S)-N-(3-chloro-2-methylphenyl)-2-[4-[4-morpholinyl(oxo)methyl]-1-piperidin-1-iumyl]propanamide IUPAC Name: (2S)-N-(3-chloro-2-methylphenyl)-2-[4-(morpholine-4-carbonyl)piperidin-1-ium-1-yl]propanamide Traditional Name: (2S)-N-(3-chloro-2-methyl-phenyl)-2-[4-(morpholine-4-carbonyl)piperidin-1-ium-1-yl]propionamide Formula: C20H29ClN3O3+ MolecularWeight: 394.91556

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1Cl)NC(=O)C(C)[NH+]2CCC(CC2)C(=O)N3CCOCC3

Isomeric SMILES

CC1=C(C=CC=C1Cl)NC(=O)[C@H](C)[NH+]2CCC(CC2)C(=O)N3CCOCC3

InChI

InChI=1S/C20H28ClN3O3/c1-14-17(21)4-3-5-18(14)22-19(25)15(2)23-8-6-16(7-9-23)20(26)24-10-12-27-13-11-24/h3-5,15-16H,6-13H2,1-2H3,(H,22,25)/p+1/t15-/m0/s1