ethyl 1-ethyl-2,5-dimethyl-4-[(E)-3-oxidanylidene-3-(2-phenoxyethylamino)prop-1-enyl]pyrrole-3-carboxylate

Systemtic Name: ethyl 1-ethyl-2,5-dimethyl-4-[(E)-3-oxidanylidene-3-(2-phenoxyethylamino)prop-1-enyl]pyrrole-3-carboxylate Openeye Name: ethyl 1-ethyl-2,5-dimethyl-4-[(E)-3-oxo-3-(2-phenoxyethylamino)prop-1-enyl]pyrrole-3-carboxylate CAS Name: 1-ethyl-2,5-dimethyl-4-[(E)-3-oxo-3-(2-phenoxyethylamino)prop-1-enyl]-3-pyrrolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-ethyl-2,5-dimethyl-4-[(E)-3-oxo-3-(2-phenoxyethylamino)prop-1-enyl]pyrrole-3-carboxylate Traditional Name: 1-ethyl-4-[(E)-3-keto-3-(2-phenoxyethylamino)prop-1-enyl]-2,5-dimethyl-pyrrole-3-carboxylic acid ethyl ester Formula: C22H28N2O4 MolecularWeight: 384.46872

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=C(C(=C1C)C(=O)OCC)C=CC(=O)NCCOC2=CC=CC=C2)C

Isomeric SMILES

CCN1C(=C(C(=C1C)C(=O)OCC)/C=C/C(=O)NCCOC2=CC=CC=C2)C

InChI

InChI=1S/C22H28N2O4/c1-5-24-16(3)19(21(17(24)4)22(26)27-6-2)12-13-20(25)23-14-15-28-18-10-8-7-9-11-18/h7-13H,5-6,14-15H2,1-4H3,(H,23,25)/b13-12+