(3S)-1-(4-methylphenyl)-N-[(1-morpholin-4-ium-4-ylcyclohexyl)methyl]-5-oxidanylidene-pyrrolidine-3-carboxamide

Systemtic Name: (3S)-1-(4-methylphenyl)-N-[(1-morpholin-4-ium-4-ylcyclohexyl)methyl]-5-oxidanylidene-pyrrolidine-3-carboxamide Openeye Name: (3S)-N-[(1-morpholin-4-ium-4-ylcyclohexyl)methyl]-5-oxo-1-(p-tolyl)pyrrolidine-3-carboxamide CAS Name: (3S)-1-(4-methylphenyl)-N-[[1-(4-morpholin-4-iumyl)cyclohexyl]methyl]-5-oxo-3-pyrrolidinecarboxamide IUPAC Name: (3S)-1-(4-methylphenyl)-N-[(1-morpholin-4-ium-4-ylcyclohexyl)methyl]-5-oxopyrrolidine-3-carboxamide Traditional Name: (3S)-5-keto-N-[(1-morpholin-4-ium-4-ylcyclohexyl)methyl]-1-(p-tolyl)pyrrolidine-3-carboxamide Formula: C23H34N3O3+ MolecularWeight: 400.53436

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2CC(CC2=O)C(=O)NCC3(CCCCC3)[NH+]4CCOCC4

Isomeric SMILES

CC1=CC=C(C=C1)N2C[C@H](CC2=O)C(=O)NCC3(CCCCC3)[NH+]4CCOCC4

InChI

InChI=1S/C23H33N3O3/c1-18-5-7-20(8-6-18)26-16-19(15-21(26)27)22(28)24-17-23(9-3-2-4-10-23)25-11-13-29-14-12-25/h5-8,19H,2-4,9-17H2,1H3,(H,24,28)/p+1/t19-/m0/s1