3-[3-(4-carbamimidoylphenyl)-2-oxidanylidene-3,8-diazaspiro[4.5]decan-8-yl]-3-oxidanylidene-propanoic acid

Systemtic Name: 3-[3-(4-carbamimidoylphenyl)-2-oxidanylidene-3,8-diazaspiro[4.5]decan-8-yl]-3-oxidanylidene-propanoic acid Openeye Name: 3-[3-(4-carbamimidoylphenyl)-2-oxo-3,8-diazaspiro[4.5]decan-8-yl]-3-oxo-propanoic acid CAS Name: 3-[3-(4-carbamimidoylphenyl)-2-oxo-3,8-diazaspiro[4.5]decan-8-yl]-3-oxopropanoic acid IUPAC Name: 3-[3-(4-carbamimidoylphenyl)-2-oxo-3,8-diazaspiro[4.5]decan-8-yl]-3-oxopropanoic acid Traditional Name: 3-[3-(4-amidinophenyl)-2-keto-3,8-diazaspiro[4.5]decan-8-yl]-3-keto-propionic acid Formula: C18H22N4O4 MolecularWeight: 358.39168

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H22N4O4/c19-17(20)12-1-3-13(4-2-12)22-11-18(10-15(22)24)5-7-21(8-6-18)14(23)9-16(25)26/h1-4H,5-11H2,(H3,19,20)(H,25,26)