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

Systemtic Name: methyl 4-[1-fluoranyl-3-[3-methyl-4-(phenylcarbamoylamino)phenyl]-2-oxidanylidene-1-pyrrolidin-1-yl-propoxy]benzoate Openeye Name: methyl 4-[1-fluoro-3-[3-methyl-4-(phenylcarbamoylamino)phenyl]-2-oxo-1-pyrrolidin-1-yl-propoxy]benzoate CAS Name: 4-[3-[4-[[anilino(oxo)methyl]amino]-3-methylphenyl]-1-fluoro-2-oxo-1-(1-pyrrolidinyl)propoxy]benzoic acid methyl ester IUPAC Name: methyl 4-[1-fluoro-3-[3-methyl-4-(phenylcarbamoylamino)phenyl]-2-oxo-1-pyrrolidin-1-ylpropoxy]benzoate Traditional Name: 4-[1-fluoro-2-keto-3-[3-methyl-4-(phenylcarbamoylamino)phenyl]-1-pyrrolidino-propoxy]benzoic acid methyl ester Formula: C29H30FN3O5 MolecularWeight: 519.564003

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)CC(=O)C(N2CCCC2)(OC3=CC=C(C=C3)C(=O)OC)F)NC(=O)NC4=CC=CC=C4

Isomeric SMILES

CC1=C(C=CC(=C1)CC(=O)C(N2CCCC2)(OC3=CC=C(C=C3)C(=O)OC)F)NC(=O)NC4=CC=CC=C4

InChI

InChI=1S/C29H30FN3O5/c1-20-18-21(10-15-25(20)32-28(36)31-23-8-4-3-5-9-23)19-26(34)29(30,33-16-6-7-17-33)38-24-13-11-22(12-14-24)27(35)37-2/h3-5,8-15,18H,6-7,16-17,19H2,1-2H3,(H2,31,32,36)