methyl 3-[[1-(4-bromophenyl)-5-oxidanylidene-pyrrolidin-3-yl]carbonylamino]-4-methyl-benzoate

Systemtic Name: methyl 3-[[1-(4-bromophenyl)-5-oxidanylidene-pyrrolidin-3-yl]carbonylamino]-4-methyl-benzoate Openeye Name: methyl 3-[[1-(4-bromophenyl)-5-oxo-pyrrolidine-3-carbonyl]amino]-4-methyl-benzoate CAS Name: 3-[[[1-(4-bromophenyl)-5-oxo-3-pyrrolidinyl]-oxomethyl]amino]-4-methylbenzoic acid methyl ester IUPAC Name: methyl 3-[[1-(4-bromophenyl)-5-oxopyrrolidine-3-carbonyl]amino]-4-methylbenzoate Traditional Name: 3-[[1-(4-bromophenyl)-5-keto-pyrrolidine-3-carbonyl]amino]-4-methyl-benzoic acid methyl ester Formula: C20H19BrN2O4 MolecularWeight: 431.27986

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)OC)NC(=O)C2CC(=O)N(C2)C3=CC=C(C=C3)Br

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)OC)NC(=O)C2CC(=O)N(C2)C3=CC=C(C=C3)Br

InChI

InChI=1S/C20H19BrN2O4/c1-12-3-4-13(20(26)27-2)9-17(12)22-19(25)14-10-18(24)23(11-14)16-7-5-15(21)6-8-16/h3-9,14H,10-11H2,1-2H3,(H,22,25)