[2-oxidanylidene-2-[(4-pyrrolidin-1-ylphenyl)amino]ethyl] 6-methanoyl-2,3-dimethoxy-benzoate

Systemtic Name: [2-oxidanylidene-2-[(4-pyrrolidin-1-ylphenyl)amino]ethyl] 6-methanoyl-2,3-dimethoxy-benzoate Openeye Name: [2-oxo-2-(4-pyrrolidin-1-ylanilino)ethyl] 6-formyl-2,3-dimethoxy-benzoate CAS Name: 6-formyl-2,3-dimethoxybenzoic acid [2-oxo-2-[4-(1-pyrrolidinyl)anilino]ethyl] ester IUPAC Name: [2-oxo-2-(4-pyrrolidin-1-ylanilino)ethyl] 6-formyl-2,3-dimethoxybenzoate Traditional Name: 6-formyl-2,3-dimethoxy-benzoic acid [2-keto-2-(4-pyrrolidinoanilino)ethyl] ester Formula: C22H24N2O6 MolecularWeight: 412.43576

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C(C=C1)C=O)C(=O)OCC(=O)NC2=CC=C(C=C2)N3CCCC3)OC

Isomeric SMILES

COC1=C(C(=C(C=C1)C=O)C(=O)OCC(=O)NC2=CC=C(C=C2)N3CCCC3)OC

InChI

InChI=1S/C22H24N2O6/c1-28-18-10-5-15(13-25)20(21(18)29-2)22(27)30-14-19(26)23-16-6-8-17(9-7-16)24-11-3-4-12-24/h5-10,13H,3-4,11-12,14H2,1-2H3,(H,23,26)