(3S)-3-(morpholin-4-ium-4-ylmethyl)-3-oxidanyl-1-[(4-propan-2-ylphenyl)methyl]piperidin-2-one

Systemtic Name: (3S)-3-(morpholin-4-ium-4-ylmethyl)-3-oxidanyl-1-[(4-propan-2-ylphenyl)methyl]piperidin-2-one Openeye Name: (3S)-3-hydroxy-1-[(4-isopropylphenyl)methyl]-3-(morpholin-4-ium-4-ylmethyl)piperidin-2-one CAS Name: (3S)-3-hydroxy-3-(4-morpholin-4-iumylmethyl)-1-[(4-propan-2-ylphenyl)methyl]-2-piperidinone IUPAC Name: (3S)-3-hydroxy-3-(morpholin-4-ium-4-ylmethyl)-1-[(4-propan-2-ylphenyl)methyl]piperidin-2-one Traditional Name: (3S)-3-hydroxy-1-(4-isopropylbenzyl)-3-(morpholin-4-ium-4-ylmethyl)-2-piperidone Formula: C20H31N2O3+ MolecularWeight: 347.47174

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)CN2CCCC(C2=O)(C[NH+]3CCOCC3)O

Isomeric SMILES

CC(C)C1=CC=C(C=C1)CN2CCC[C@@](C2=O)(C[NH+]3CCOCC3)O

InChI

InChI=1S/C20H30N2O3/c1-16(2)18-6-4-17(5-7-18)14-22-9-3-8-20(24,19(22)23)15-21-10-12-25-13-11-21/h4-7,16,24H,3,8-15H2,1-2H3/p+1/t20-/m0/s1