(phenylmethyl) 4-[3-(2-methanoylpyrrolidin-1-yl)-2-(methylamino)-3-oxidanylidene-propyl]benzoate

Systemtic Name: (phenylmethyl) 4-[3-(2-methanoylpyrrolidin-1-yl)-2-(methylamino)-3-oxidanylidene-propyl]benzoate Openeye Name: benzyl 4-[3-(2-formylpyrrolidin-1-yl)-2-(methylamino)-3-oxo-propyl]benzoate CAS Name: 4-[3-(2-formyl-1-pyrrolidinyl)-2-(methylamino)-3-oxopropyl]benzoic acid (phenylmethyl) ester IUPAC Name: benzyl 4-[3-(2-formylpyrrolidin-1-yl)-2-(methylamino)-3-oxopropyl]benzoate Traditional Name: 4-[3-(2-formylpyrrolidino)-3-keto-2-(methylamino)propyl]benzoic acid benzyl ester Formula: C23H26N2O4 MolecularWeight: 394.46354

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Descriptors Computed from Structure

Canonical SMILES:

CNC(CC1=CC=C(C=C1)C(=O)OCC2=CC=CC=C2)C(=O)N3CCCC3C=O

Isomeric SMILES

CNC(CC1=CC=C(C=C1)C(=O)OCC2=CC=CC=C2)C(=O)N3CCCC3C=O

InChI

InChI=1S/C23H26N2O4/c1-24-21(22(27)25-13-5-8-20(25)15-26)14-17-9-11-19(12-10-17)23(28)29-16-18-6-3-2-4-7-18/h2-4,6-7,9-12,15,20-21,24H,5,8,13-14,16H2,1H3