2-[[5-(1H-indol-4-yl)-1-benzofuran-2-yl]methoxycarbonylamino]-3-phenyl-propanoic acid

Systemtic Name: 2-[[5-(1H-indol-4-yl)-1-benzofuran-2-yl]methoxycarbonylamino]-3-phenyl-propanoic acid Openeye Name: 2-[[5-(1H-indol-4-yl)benzofuran-2-yl]methoxycarbonylamino]-3-phenyl-propanoic acid CAS Name: 2-[[[5-(1H-indol-4-yl)-2-benzofuranyl]methoxy-oxomethyl]amino]-3-phenylpropanoic acid IUPAC Name: 2-[[5-(1H-indol-4-yl)-1-benzofuran-2-yl]methoxycarbonylamino]-3-phenylpropanoic acid Traditional Name: 2-[[5-(1H-indol-4-yl)benzofuran-2-yl]methoxycarbonylamino]-3-phenyl-propionic acid Formula: C27H22N2O5 MolecularWeight: 454.47398

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(C(=O)O)NC(=O)OCC2=CC3=C(O2)C=CC(=C3)C4=C5C=CNC5=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)CC(C(=O)O)NC(=O)OCC2=CC3=C(O2)C=CC(=C3)C4=C5C=CNC5=CC=C4

InChI

InChI=1S/C27H22N2O5/c30-26(31)24(13-17-5-2-1-3-6-17)29-27(32)33-16-20-15-19-14-18(9-10-25(19)34-20)21-7-4-8-23-22(21)11-12-28-23/h1-12,14-15,24,28H,13,16H2,(H,29,32)(H,30,31)