7-[(5-carbamimidoyl-2,3-dihydro-1-benzofuran-2-yl)carbonylamino]heptanoic acid

Systemtic Name: 7-[(5-carbamimidoyl-2,3-dihydro-1-benzofuran-2-yl)carbonylamino]heptanoic acid Openeye Name: 7-[(5-carbamimidoyl-2,3-dihydrobenzofuran-2-carbonyl)amino]heptanoic acid CAS Name: 7-[[(5-carbamimidoyl-2,3-dihydrobenzofuran-2-yl)-oxomethyl]amino]heptanoic acid IUPAC Name: 7-[(5-carbamimidoyl-2,3-dihydro-1-benzofuran-2-carbonyl)amino]heptanoic acid Traditional Name: 7-[(5-amidinocoumaran-2-carbonyl)amino]enanthic acid Formula: C17H23N3O4 MolecularWeight: 333.38222

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Descriptors Computed from Structure

Canonical SMILES:

C1C(OC2=C1C=C(C=C2)C(=N)N)C(=O)NCCCCCCC(=O)O

Isomeric SMILES

C1C(OC2=C1C=C(C=C2)C(=N)N)C(=O)NCCCCCCC(=O)O

InChI

InChI=1S/C17H23N3O4/c18-16(19)11-6-7-13-12(9-11)10-14(24-13)17(23)20-8-4-2-1-3-5-15(21)22/h6-7,9,14H,1-5,8,10H2,(H3,18,19)(H,20,23)(H,21,22)