methyl 2-[[5-(1,3-benzodioxol-5-yl)-2-oxidanyl-phenyl]carbonylamino]-3-(4-phenylphenyl)propanoate

Systemtic Name: methyl 2-[[5-(1,3-benzodioxol-5-yl)-2-oxidanyl-phenyl]carbonylamino]-3-(4-phenylphenyl)propanoate Openeye Name: methyl 2-[[5-(1,3-benzodioxol-5-yl)-2-hydroxy-benzoyl]amino]-3-(4-phenylphenyl)propanoate CAS Name: 2-[[[5-(1,3-benzodioxol-5-yl)-2-hydroxyphenyl]-oxomethyl]amino]-3-(4-phenylphenyl)propanoic acid methyl ester IUPAC Name: methyl 2-[[5-(1,3-benzodioxol-5-yl)-2-hydroxybenzoyl]amino]-3-(4-phenylphenyl)propanoate Traditional Name: 2-[[5-(1,3-benzodioxol-5-yl)-2-hydroxy-benzoyl]amino]-3-(4-phenylphenyl)propionic acid methyl ester Formula: C30H25NO6 MolecularWeight: 495.5226

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CC1=CC=C(C=C1)C2=CC=CC=C2)NC(=O)C3=C(C=CC(=C3)C4=CC5=C(C=C4)OCO5)O

Isomeric SMILES

COC(=O)C(CC1=CC=C(C=C1)C2=CC=CC=C2)NC(=O)C3=C(C=CC(=C3)C4=CC5=C(C=C4)OCO5)O

InChI

InChI=1S/C30H25NO6/c1-35-30(34)25(15-19-7-9-21(10-8-19)20-5-3-2-4-6-20)31-29(33)24-16-22(11-13-26(24)32)23-12-14-27-28(17-23)37-18-36-27/h2-14,16-17,25,32H,15,18H2,1H3,(H,31,33)