2-[5-[[4-(5-carbamimidoylpyrazin-2-yl)phenoxy]methyl]-2-oxidanylidene-pyrrolidin-3-yl]ethanoic acid

Systemtic Name: 2-[5-[[4-(5-carbamimidoylpyrazin-2-yl)phenoxy]methyl]-2-oxidanylidene-pyrrolidin-3-yl]ethanoic acid Openeye Name: 2-[5-[[4-(5-carbamimidoylpyrazin-2-yl)phenoxy]methyl]-2-oxo-pyrrolidin-3-yl]acetic acid CAS Name: 2-[5-[[4-(5-carbamimidoyl-2-pyrazinyl)phenoxy]methyl]-2-oxo-3-pyrrolidinyl]acetic acid IUPAC Name: 2-[5-[[4-(5-carbamimidoylpyrazin-2-yl)phenoxy]methyl]-2-oxopyrrolidin-3-yl]acetic acid Traditional Name: 2-[5-[[4-(5-amidinopyrazin-2-yl)phenoxy]methyl]-2-keto-pyrrolidin-3-yl]acetic acid Formula: C18H19N5O4 MolecularWeight: 369.37456

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C(=O)NC1COC2=CC=C(C=C2)C3=CN=C(C=N3)C(=N)N)CC(=O)O

Isomeric SMILES

C1C(C(=O)NC1COC2=CC=C(C=C2)C3=CN=C(C=N3)C(=N)N)CC(=O)O

InChI

InChI=1S/C18H19N5O4/c19-17(20)15-8-21-14(7-22-15)10-1-3-13(4-2-10)27-9-12-5-11(6-16(24)25)18(26)23-12/h1-4,7-8,11-12H,5-6,9H2,(H3,19,20)(H,23,26)(H,24,25)