4-benzamido-4-[4-[2-[4-(2,3-dihydroindol-1-ylcarbonylamino)-3-methoxy-phenyl]ethanoylamino]phenyl]butanoic acid

Systemtic Name: 4-benzamido-4-[4-[2-[4-(2,3-dihydroindol-1-ylcarbonylamino)-3-methoxy-phenyl]ethanoylamino]phenyl]butanoic acid Openeye Name: 4-benzamido-4-[4-[[2-[4-(indoline-1-carbonylamino)-3-methoxy-phenyl]acetyl]amino]phenyl]butanoic acid CAS Name: 4-benzamido-4-[4-[[2-[4-[[2,3-dihydroindol-1-yl(oxo)methyl]amino]-3-methoxyphenyl]-1-oxoethyl]amino]phenyl]butanoic acid IUPAC Name: 4-benzamido-4-[4-[[2-[4-(2,3-dihydroindole-1-carbonylamino)-3-methoxyphenyl]acetyl]amino]phenyl]butanoic acid Traditional Name: 4-benzamido-4-[4-[[2-[4-(indoline-1-carbonylamino)-3-methoxy-phenyl]acetyl]amino]phenyl]butyric acid Formula: C35H34N4O6 MolecularWeight: 606.66766

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)CC(=O)NC2=CC=C(C=C2)C(CCC(=O)O)NC(=O)C3=CC=CC=C3)NC(=O)N4CCC5=CC=CC=C54

Isomeric SMILES

COC1=C(C=CC(=C1)CC(=O)NC2=CC=C(C=C2)C(CCC(=O)O)NC(=O)C3=CC=CC=C3)NC(=O)N4CCC5=CC=CC=C54

InChI

InChI=1S/C35H34N4O6/c1-45-31-21-23(11-16-29(31)38-35(44)39-20-19-25-7-5-6-10-30(25)39)22-32(40)36-27-14-12-24(13-15-27)28(17-18-33(41)42)37-34(43)26-8-3-2-4-9-26/h2-16,21,28H,17-20,22H2,1H3,(H,36,40)(H,37,43)(H,38,44)(H,41,42)