2-[3-[4-(6-carbamimidoylpyridazin-3-yl)phenyl]-1-methanoyl-2-oxidanylidene-pyrrolidin-3-yl]ethanoic acid

Systemtic Name: 2-[3-[4-(6-carbamimidoylpyridazin-3-yl)phenyl]-1-methanoyl-2-oxidanylidene-pyrrolidin-3-yl]ethanoic acid Openeye Name: 2-[3-[4-(6-carbamimidoylpyridazin-3-yl)phenyl]-1-formyl-2-oxo-pyrrolidin-3-yl]acetic acid CAS Name: 2-[3-[4-(6-carbamimidoyl-3-pyridazinyl)phenyl]-1-formyl-2-oxo-3-pyrrolidinyl]acetic acid IUPAC Name: 2-[3-[4-(6-carbamimidoylpyridazin-3-yl)phenyl]-1-formyl-2-oxopyrrolidin-3-yl]acetic acid Traditional Name: 2-[3-[4-(6-amidinopyridazin-3-yl)phenyl]-1-formyl-2-keto-pyrrolidin-3-yl]acetic acid Formula: C18H17N5O4 MolecularWeight: 367.35868

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(=O)C1(CC(=O)O)C2=CC=C(C=C2)C3=NN=C(C=C3)C(=N)N)C=O

Isomeric SMILES

C1CN(C(=O)C1(CC(=O)O)C2=CC=C(C=C2)C3=NN=C(C=C3)C(=N)N)C=O

InChI

InChI=1S/C18H17N5O4/c19-16(20)14-6-5-13(21-22-14)11-1-3-12(4-2-11)18(9-15(25)26)7-8-23(10-24)17(18)27/h1-6,10H,7-9H2,(H3,19,20)(H,25,26)