methyl 4-[1-fluoranyl-3-[4-[(2-iodanylphenyl)carbamoylamino]-3-methoxy-phenyl]-2-oxidanylidene-1-pyrrolidin-1-yl-propoxy]benzoate

Systemtic Name: methyl 4-[1-fluoranyl-3-[4-[(2-iodanylphenyl)carbamoylamino]-3-methoxy-phenyl]-2-oxidanylidene-1-pyrrolidin-1-yl-propoxy]benzoate Openeye Name: methyl 4-[1-fluoro-3-[4-[(2-iodophenyl)carbamoylamino]-3-methoxy-phenyl]-2-oxo-1-pyrrolidin-1-yl-propoxy]benzoate CAS Name: 4-[1-fluoro-3-[4-[[(2-iodoanilino)-oxomethyl]amino]-3-methoxyphenyl]-2-oxo-1-(1-pyrrolidinyl)propoxy]benzoic acid methyl ester IUPAC Name: methyl 4-[1-fluoro-3-[4-[(2-iodophenyl)carbamoylamino]-3-methoxyphenyl]-2-oxo-1-pyrrolidin-1-ylpropoxy]benzoate Traditional Name: 4-[1-fluoro-3-[4-[(2-iodophenyl)carbamoylamino]-3-methoxy-phenyl]-2-keto-1-pyrrolidino-propoxy]benzoic acid methyl ester Formula: C29H29FIN3O6 MolecularWeight: 661.459933

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)CC(=O)C(N2CCCC2)(OC3=CC=C(C=C3)C(=O)OC)F)NC(=O)NC4=CC=CC=C4I

Isomeric SMILES

COC1=C(C=CC(=C1)CC(=O)C(N2CCCC2)(OC3=CC=C(C=C3)C(=O)OC)F)NC(=O)NC4=CC=CC=C4I

InChI

InChI=1S/C29H29FIN3O6/c1-38-25-17-19(9-14-24(25)33-28(37)32-23-8-4-3-7-22(23)31)18-26(35)29(30,34-15-5-6-16-34)40-21-12-10-20(11-13-21)27(36)39-2/h3-4,7-14,17H,5-6,15-16,18H2,1-2H3,(H2,32,33,37)