(Z)-1-[5-ethoxycarbonyl-3-[2-oxidanylidene-1-(phenylmethyl)pyrrolidin-3-yl]-1H-pyrrol-2-yl]-1-oxidanyl-3-oxidanylidene-but-1-ene-2-diazonium

Systemtic Name: (Z)-1-[5-ethoxycarbonyl-3-[2-oxidanylidene-1-(phenylmethyl)pyrrolidin-3-yl]-1H-pyrrol-2-yl]-1-oxidanyl-3-oxidanylidene-but-1-ene-2-diazonium Openeye Name: (Z)-1-[3-(1-benzyl-2-oxo-pyrrolidin-3-yl)-5-ethoxycarbonyl-1H-pyrrol-2-yl]-1-hydroxy-3-oxo-but-1-ene-2-diazonium CAS Name: (Z)-1-[5-ethoxycarbonyl-3-[2-oxo-1-(phenylmethyl)-3-pyrrolidinyl]-1H-pyrrol-2-yl]-1-hydroxy-3-oxo-1-butene-2-diazonium IUPAC Name: (Z)-1-[3-(1-benzyl-2-oxopyrrolidin-3-yl)-5-ethoxycarbonyl-1H-pyrrol-2-yl]-1-hydroxy-3-oxobut-1-ene-2-diazonium Traditional Name: (Z)-1-[3-(1-benzyl-2-keto-pyrrolidin-3-yl)-5-carbethoxy-1H-pyrrol-2-yl]-1-hydroxy-3-keto-but-1-ene-2-diazonium Formula: C22H23N4O5+ MolecularWeight: 423.44182

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=C(N1)C(=C(C(=O)C)[N+]#N)O)C2CCN(C2=O)CC3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C1=CC(=C(N1)/C(=C(\C(=O)C)/[N+]#N)/O)C2CCN(C2=O)CC3=CC=CC=C3

InChI

InChI=1S/C22H22N4O5/c1-3-31-22(30)17-11-16(19(24-17)20(28)18(25-23)13(2)27)15-9-10-26(21(15)29)12-14-7-5-4-6-8-14/h4-8,11,15H,3,9-10,12H2,1-2H3,(H-,24,27,28,30)/p+1