2-[[2-acetamido-3-(4-carbamimidoylphenyl)propanoyl]amino]-2-cyclohexyl-ethanoic acid

Systemtic Name: 2-[[2-acetamido-3-(4-carbamimidoylphenyl)propanoyl]amino]-2-cyclohexyl-ethanoic acid Openeye Name: 2-[[2-acetamido-3-(4-carbamimidoylphenyl)propanoyl]amino]-2-cyclohexyl-acetic acid CAS Name: 2-[[2-acetamido-3-(4-carbamimidoylphenyl)-1-oxopropyl]amino]-2-cyclohexylacetic acid IUPAC Name: 2-[[2-acetamido-3-(4-carbamimidoylphenyl)propanoyl]amino]-2-cyclohexylacetic acid Traditional Name: 2-[[2-acetamido-3-(4-amidinophenyl)propanoyl]amino]-2-cyclohexyl-acetic acid Formula: C20H28N4O4 MolecularWeight: 388.46072

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC(CC1=CC=C(C=C1)C(=N)N)C(=O)NC(C2CCCCC2)C(=O)O

Isomeric SMILES

CC(=O)NC(CC1=CC=C(C=C1)C(=N)N)C(=O)NC(C2CCCCC2)C(=O)O

InChI

InChI=1S/C20H28N4O4/c1-12(25)23-16(11-13-7-9-15(10-8-13)18(21)22)19(26)24-17(20(27)28)14-5-3-2-4-6-14/h7-10,14,16-17H,2-6,11H2,1H3,(H3,21,22)(H,23,25)(H,24,26)(H,27,28)