phenyl 2-[(5-carbamimidoyl-1-benzofuran-2-yl)carbonylamino]-2-(phenylmethoxycarbonylamino)propanoate

Systemtic Name: phenyl 2-[(5-carbamimidoyl-1-benzofuran-2-yl)carbonylamino]-2-(phenylmethoxycarbonylamino)propanoate Openeye Name: phenyl 2-(benzyloxycarbonylamino)-2-[(5-carbamimidoylbenzofuran-2-carbonyl)amino]propanoate CAS Name: 2-[[(5-carbamimidoyl-2-benzofuranyl)-oxomethyl]amino]-2-(phenylmethoxycarbonylamino)propanoic acid phenyl ester IUPAC Name: phenyl 2-[(5-carbamimidoyl-1-benzofuran-2-carbonyl)amino]-2-(phenylmethoxycarbonylamino)propanoate Traditional Name: 2-[(5-amidinobenzofuran-2-carbonyl)amino]-2-(benzyloxycarbonylamino)propionic acid phenyl ester Formula: C27H24N4O6 MolecularWeight: 500.50266

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)OC1=CC=CC=C1)(NC(=O)C2=CC3=C(O2)C=CC(=C3)C(=N)N)NC(=O)OCC4=CC=CC=C4

Isomeric SMILES

CC(C(=O)OC1=CC=CC=C1)(NC(=O)C2=CC3=C(O2)C=CC(=C3)C(=N)N)NC(=O)OCC4=CC=CC=C4

InChI

InChI=1S/C27H24N4O6/c1-27(25(33)36-20-10-6-3-7-11-20,31-26(34)35-16-17-8-4-2-5-9-17)30-24(32)22-15-19-14-18(23(28)29)12-13-21(19)37-22/h2-15H,16H2,1H3,(H3,28,29)(H,30,32)(H,31,34)