2-[4-[3-[(4-carbamimidoylphenyl)carbonylamino]propanoyl]piperazin-1-yl]ethanoic acid

Systemtic Name: 2-[4-[3-[(4-carbamimidoylphenyl)carbonylamino]propanoyl]piperazin-1-yl]ethanoic acid Openeye Name: 2-[4-[3-[(4-carbamimidoylbenzoyl)amino]propanoyl]piperazin-1-yl]acetic acid CAS Name: 2-[4-[3-[[(4-carbamimidoylphenyl)-oxomethyl]amino]-1-oxopropyl]-1-piperazinyl]acetic acid IUPAC Name: 2-[4-[3-[(4-carbamimidoylbenzoyl)amino]propanoyl]piperazin-1-yl]acetic acid Traditional Name: 2-[4-[3-[(4-amidinobenzoyl)amino]propanoyl]piperazino]acetic acid Formula: C17H23N5O4 MolecularWeight: 361.39562

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC(=O)O)C(=O)CCNC(=O)C2=CC=C(C=C2)C(=N)N

Isomeric SMILES

C1CN(CCN1CC(=O)O)C(=O)CCNC(=O)C2=CC=C(C=C2)C(=N)N

InChI

InChI=1S/C17H23N5O4/c18-16(19)12-1-3-13(4-2-12)17(26)20-6-5-14(23)22-9-7-21(8-10-22)11-15(24)25/h1-4H,5-11H2,(H3,18,19)(H,20,26)(H,24,25)