(2S)-2-(4-morpholin-4-ylcarbonylpiperidin-1-ium-1-yl)-N-phenyl-butanamide

Systemtic Name: (2S)-2-(4-morpholin-4-ylcarbonylpiperidin-1-ium-1-yl)-N-phenyl-butanamide Openeye Name: (2S)-2-[4-(morpholine-4-carbonyl)piperidin-1-ium-1-yl]-N-phenyl-butanamide CAS Name: (2S)-2-[4-[4-morpholinyl(oxo)methyl]-1-piperidin-1-iumyl]-N-phenylbutanamide IUPAC Name: (2S)-2-[4-(morpholine-4-carbonyl)piperidin-1-ium-1-yl]-N-phenylbutanamide Traditional Name: (2S)-2-[4-(morpholine-4-carbonyl)piperidin-1-ium-1-yl]-N-phenyl-butyramide Formula: C20H30N3O3+ MolecularWeight: 360.4705

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=CC=CC=C1)[NH+]2CCC(CC2)C(=O)N3CCOCC3

Isomeric SMILES

CC[C@@H](C(=O)NC1=CC=CC=C1)[NH+]2CCC(CC2)C(=O)N3CCOCC3

InChI

InChI=1S/C20H29N3O3/c1-2-18(19(24)21-17-6-4-3-5-7-17)22-10-8-16(9-11-22)20(25)23-12-14-26-15-13-23/h3-7,16,18H,2,8-15H2,1H3,(H,21,24)/p+1/t18-/m0/s1