1-[(3S)-2,5-bis(oxidanylidene)-1-(4-propan-2-ylphenyl)pyrrolidin-3-yl]piperidin-1-ium-4-carboxamide

Systemtic Name: 1-[(3S)-2,5-bis(oxidanylidene)-1-(4-propan-2-ylphenyl)pyrrolidin-3-yl]piperidin-1-ium-4-carboxamide Openeye Name: 1-[(3S)-1-(4-isopropylphenyl)-2,5-dioxo-pyrrolidin-3-yl]piperidin-1-ium-4-carboxamide CAS Name: 1-[(3S)-2,5-dioxo-1-(4-propan-2-ylphenyl)-3-pyrrolidinyl]-4-piperidin-1-iumcarboxamide IUPAC Name: 1-[(3S)-2,5-dioxo-1-(4-propan-2-ylphenyl)pyrrolidin-3-yl]piperidin-1-ium-4-carboxamide Traditional Name: 1-[(3S)-2,5-diketo-1-p-cumenyl-pyrrolidin-3-yl]piperidin-1-ium-4-carboxamide Formula: C19H26N3O3+ MolecularWeight: 344.42804

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)N2C(=O)CC(C2=O)[NH+]3CCC(CC3)C(=O)N

Isomeric SMILES

CC(C)C1=CC=C(C=C1)N2C(=O)C[C@@H](C2=O)[NH+]3CCC(CC3)C(=O)N

InChI

InChI=1S/C19H25N3O3/c1-12(2)13-3-5-15(6-4-13)22-17(23)11-16(19(22)25)21-9-7-14(8-10-21)18(20)24/h3-6,12,14,16H,7-11H2,1-2H3,(H2,20,24)/p+1/t16-/m0/s1