5-[3-(4-carbamimidoylphenyl)-4-oxidanylidene-3,8-diazaspiro[4.5]decan-8-yl]pentanoic acid

Systemtic Name: 5-[3-(4-carbamimidoylphenyl)-4-oxidanylidene-3,8-diazaspiro[4.5]decan-8-yl]pentanoic acid Openeye Name: 5-[3-(4-carbamimidoylphenyl)-4-oxo-3,8-diazaspiro[4.5]decan-8-yl]pentanoic acid CAS Name: 5-[3-(4-carbamimidoylphenyl)-4-oxo-3,8-diazaspiro[4.5]decan-8-yl]pentanoic acid IUPAC Name: 5-[3-(4-carbamimidoylphenyl)-4-oxo-3,8-diazaspiro[4.5]decan-8-yl]pentanoic acid Traditional Name: 5-[3-(4-amidinophenyl)-4-keto-3,8-diazaspiro[4.5]decan-8-yl]valeric acid Formula: C20H28N4O3 MolecularWeight: 372.46132

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC12CCN(C2=O)C3=CC=C(C=C3)C(=N)N)CCCCC(=O)O

Isomeric SMILES

C1CN(CCC12CCN(C2=O)C3=CC=C(C=C3)C(=N)N)CCCCC(=O)O

InChI

InChI=1S/C20H28N4O3/c21-18(22)15-4-6-16(7-5-15)24-14-10-20(19(24)27)8-12-23(13-9-20)11-2-1-3-17(25)26/h4-7H,1-3,8-14H2,(H3,21,22)(H,25,26)