3-[3-(4-carbamimidoylphenyl)-8-azaspiro[4.5]dec-2-en-8-yl]-3-oxidanylidene-propanoic acid

Systemtic Name: 3-[3-(4-carbamimidoylphenyl)-8-azaspiro[4.5]dec-2-en-8-yl]-3-oxidanylidene-propanoic acid Openeye Name: 3-[3-(4-carbamimidoylphenyl)-8-azaspiro[4.5]dec-2-en-8-yl]-3-oxo-propanoic acid CAS Name: 3-[3-(4-carbamimidoylphenyl)-8-azaspiro[4.5]dec-2-en-8-yl]-3-oxopropanoic acid IUPAC Name: 3-[3-(4-carbamimidoylphenyl)-8-azaspiro[4.5]dec-2-en-8-yl]-3-oxopropanoic acid Traditional Name: 3-[3-(4-amidinophenyl)-8-azaspiro[4.5]dec-2-en-8-yl]-3-keto-propionic acid Formula: C19H23N3O3 MolecularWeight: 341.40422

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC12CC=C(C2)C3=CC=C(C=C3)C(=N)N)C(=O)CC(=O)O

Isomeric SMILES

C1CN(CCC12CC=C(C2)C3=CC=C(C=C3)C(=N)N)C(=O)CC(=O)O

InChI

InChI=1S/C19H23N3O3/c20-18(21)14-3-1-13(2-4-14)15-5-6-19(12-15)7-9-22(10-8-19)16(23)11-17(24)25/h1-5H,6-12H2,(H3,20,21)(H,24,25)