3-[4-(4-carbamimidoylphenyl)butylcarbamoylamino]-3-phenyl-propanoic acid

Systemtic Name: 3-[4-(4-carbamimidoylphenyl)butylcarbamoylamino]-3-phenyl-propanoic acid Openeye Name: 3-[4-(4-carbamimidoylphenyl)butylcarbamoylamino]-3-phenyl-propanoic acid CAS Name: 3-[[[4-(4-carbamimidoylphenyl)butylamino]-oxomethyl]amino]-3-phenylpropanoic acid IUPAC Name: 3-[4-(4-carbamimidoylphenyl)butylcarbamoylamino]-3-phenylpropanoic acid Traditional Name: 3-[4-(4-amidinophenyl)butylcarbamoylamino]-3-phenyl-propionic acid Formula: C21H26N4O3 MolecularWeight: 382.45614

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(CC(=O)O)NC(=O)NCCCCC2=CC=C(C=C2)C(=N)N

Isomeric SMILES

C1=CC=C(C=C1)C(CC(=O)O)NC(=O)NCCCCC2=CC=C(C=C2)C(=N)N

InChI

InChI=1S/C21H26N4O3/c22-20(23)17-11-9-15(10-12-17)6-4-5-13-24-21(28)25-18(14-19(26)27)16-7-2-1-3-8-16/h1-3,7-12,18H,4-6,13-14H2,(H3,22,23)(H,26,27)(H2,24,25,28)