2-[[3-(4-carbamimidoylphenyl)-2-phenyl-propanoyl]amino]hexanoic acid

Systemtic Name: 2-[[3-(4-carbamimidoylphenyl)-2-phenyl-propanoyl]amino]hexanoic acid Openeye Name: 2-[[3-(4-carbamimidoylphenyl)-2-phenyl-propanoyl]amino]hexanoic acid CAS Name: 2-[[3-(4-carbamimidoylphenyl)-1-oxo-2-phenylpropyl]amino]hexanoic acid IUPAC Name: 2-[[3-(4-carbamimidoylphenyl)-2-phenylpropanoyl]amino]hexanoic acid Traditional Name: 2-[[3-(4-amidinophenyl)-2-phenyl-propanoyl]amino]hexanoic acid Formula: C22H27N3O3 MolecularWeight: 381.46808

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C(=O)O)NC(=O)C(CC1=CC=C(C=C1)C(=N)N)C2=CC=CC=C2

Isomeric SMILES

CCCCC(C(=O)O)NC(=O)C(CC1=CC=C(C=C1)C(=N)N)C2=CC=CC=C2

InChI

InChI=1S/C22H27N3O3/c1-2-3-9-19(22(27)28)25-21(26)18(16-7-5-4-6-8-16)14-15-10-12-17(13-11-15)20(23)24/h4-8,10-13,18-19H,2-3,9,14H2,1H3,(H3,23,24)(H,25,26)(H,27,28)