1-[(3S)-1-(5-methoxy-2-methyl-phenyl)-2,5-bis(oxidanylidene)pyrrolidin-3-yl]piperidin-1-ium-4-carboxamide

Systemtic Name: 1-[(3S)-1-(5-methoxy-2-methyl-phenyl)-2,5-bis(oxidanylidene)pyrrolidin-3-yl]piperidin-1-ium-4-carboxamide Openeye Name: 1-[(3S)-1-(5-methoxy-2-methyl-phenyl)-2,5-dioxo-pyrrolidin-3-yl]piperidin-1-ium-4-carboxamide CAS Name: 1-[(3S)-1-(5-methoxy-2-methylphenyl)-2,5-dioxo-3-pyrrolidinyl]-4-piperidin-1-iumcarboxamide IUPAC Name: 1-[(3S)-1-(5-methoxy-2-methylphenyl)-2,5-dioxopyrrolidin-3-yl]piperidin-1-ium-4-carboxamide Traditional Name: 1-[(3S)-2,5-diketo-1-(5-methoxy-2-methyl-phenyl)pyrrolidin-3-yl]piperidin-1-ium-4-carboxamide Formula: C18H24N3O4+ MolecularWeight: 346.40086

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)OC)N2C(=O)CC(C2=O)[NH+]3CCC(CC3)C(=O)N

Isomeric SMILES

CC1=C(C=C(C=C1)OC)N2C(=O)C[C@@H](C2=O)[NH+]3CCC(CC3)C(=O)N

InChI

InChI=1S/C18H23N3O4/c1-11-3-4-13(25-2)9-14(11)21-16(22)10-15(18(21)24)20-7-5-12(6-8-20)17(19)23/h3-4,9,12,15H,5-8,10H2,1-2H3,(H2,19,23)/p+1/t15-/m0/s1