1-[3-[3-(methylamino)-2-oxidanylidene-pyrrolidin-1-yl]-2-oxidanylidene-butyl]pyridin-1-ium-4-carboxamide

Systemtic Name: 1-[3-[3-(methylamino)-2-oxidanylidene-pyrrolidin-1-yl]-2-oxidanylidene-butyl]pyridin-1-ium-4-carboxamide Openeye Name: 1-[3-[3-(methylamino)-2-oxo-pyrrolidin-1-yl]-2-oxo-butyl]pyridin-1-ium-4-carboxamide CAS Name: 1-[3-[3-(methylamino)-2-oxo-1-pyrrolidinyl]-2-oxobutyl]-4-pyridin-1-iumcarboxamide IUPAC Name: 1-[3-[3-(methylamino)-2-oxopyrrolidin-1-yl]-2-oxobutyl]pyridin-1-ium-4-carboxamide Traditional Name: 1-[2-keto-3-[2-keto-3-(methylamino)pyrrolidino]butyl]pyridin-1-ium-4-carboxamide Formula: C15H21N4O3+ MolecularWeight: 305.35224

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)C[N+]1=CC=C(C=C1)C(=O)N)N2CCC(C2=O)NC

Isomeric SMILES

CC(C(=O)C[N+]1=CC=C(C=C1)C(=O)N)N2CCC(C2=O)NC

InChI

InChI=1S/C15H20N4O3/c1-10(19-8-5-12(17-2)15(19)22)13(20)9-18-6-3-11(4-7-18)14(16)21/h3-4,6-7,10,12,17H,5,8-9H2,1-2H3,(H-,16,21)/p+1