4-(3-carbamimidoylphenoxy)-3-[methyl-(4-piperidin-4-ylphenyl)carbonyl-amino]butanoic acid

Systemtic Name: 4-(3-carbamimidoylphenoxy)-3-[methyl-(4-piperidin-4-ylphenyl)carbonyl-amino]butanoic acid Openeye Name: 4-(3-carbamimidoylphenoxy)-3-[methyl-[4-(4-piperidyl)benzoyl]amino]butanoic acid CAS Name: 4-(3-carbamimidoylphenoxy)-3-[methyl-[oxo-[4-(4-piperidinyl)phenyl]methyl]amino]butanoic acid IUPAC Name: 4-(3-carbamimidoylphenoxy)-3-[methyl-(4-piperidin-4-ylbenzoyl)amino]butanoic acid Traditional Name: 4-(3-amidinophenoxy)-3-[methyl-[4-(4-piperidyl)benzoyl]amino]butyric acid Formula: C24H30N4O4 MolecularWeight: 438.5194

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Descriptors Computed from Structure

Canonical SMILES:

CN(C(CC(=O)O)COC1=CC=CC(=C1)C(=N)N)C(=O)C2=CC=C(C=C2)C3CCNCC3

Isomeric SMILES

CN(C(CC(=O)O)COC1=CC=CC(=C1)C(=N)N)C(=O)C2=CC=C(C=C2)C3CCNCC3

InChI

InChI=1S/C24H30N4O4/c1-28(24(31)18-7-5-16(6-8-18)17-9-11-27-12-10-17)20(14-22(29)30)15-32-21-4-2-3-19(13-21)23(25)26/h2-8,13,17,20,27H,9-12,14-15H2,1H3,(H3,25,26)(H,29,30)