[4-[2-(ethylamino)-2-oxidanylidene-ethyl]phenyl]methyl 1,4-dimethylpyrrole-2-carboxylate

Systemtic Name: [4-[2-(ethylamino)-2-oxidanylidene-ethyl]phenyl]methyl 1,4-dimethylpyrrole-2-carboxylate Openeye Name: [4-[2-(ethylamino)-2-oxo-ethyl]phenyl]methyl 1,4-dimethylpyrrole-2-carboxylate CAS Name: 1,4-dimethyl-2-pyrrolecarboxylic acid [4-[2-(ethylamino)-2-oxoethyl]phenyl]methyl ester IUPAC Name: [4-[2-(ethylamino)-2-oxoethyl]phenyl]methyl 1,4-dimethylpyrrole-2-carboxylate Traditional Name: 1,4-dimethylpyrrole-2-carboxylic acid [4-[2-(ethylamino)-2-keto-ethyl]benzyl] ester Formula: C18H22N2O3 MolecularWeight: 314.37888

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)CC1=CC=C(C=C1)COC(=O)C2=CC(=CN2C)C

Isomeric SMILES

CCNC(=O)CC1=CC=C(C=C1)COC(=O)C2=CC(=CN2C)C

InChI

InChI=1S/C18H22N2O3/c1-4-19-17(21)10-14-5-7-15(8-6-14)12-23-18(22)16-9-13(2)11-20(16)3/h5-9,11H,4,10,12H2,1-3H3,(H,19,21)