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

Systemtic Name: ethyl 1-ethyl-4-[(E)-3-[(2-methoxypyridin-3-yl)methylamino]-3-oxidanylidene-prop-1-enyl]-2,5-dimethyl-pyrrole-3-carboxylate Openeye Name: ethyl 1-ethyl-4-[(E)-3-[(2-methoxy-3-pyridyl)methylamino]-3-oxo-prop-1-enyl]-2,5-dimethyl-pyrrole-3-carboxylate CAS Name: 1-ethyl-4-[(E)-3-[(2-methoxy-3-pyridinyl)methylamino]-3-oxoprop-1-enyl]-2,5-dimethyl-3-pyrrolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-ethyl-4-[(E)-3-[(2-methoxypyridin-3-yl)methylamino]-3-oxoprop-1-enyl]-2,5-dimethylpyrrole-3-carboxylate Traditional Name: 1-ethyl-4-[(E)-3-keto-3-[(2-methoxy-3-pyridyl)methylamino]prop-1-enyl]-2,5-dimethyl-pyrrole-3-carboxylic acid ethyl ester Formula: C21H27N3O4 MolecularWeight: 385.45678

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=C(C(=C1C)C(=O)OCC)C=CC(=O)NCC2=C(N=CC=C2)OC)C

Isomeric SMILES

CCN1C(=C(C(=C1C)C(=O)OCC)/C=C/C(=O)NCC2=C(N=CC=C2)OC)C

InChI

InChI=1S/C21H27N3O4/c1-6-24-14(3)17(19(15(24)4)21(26)28-7-2)10-11-18(25)23-13-16-9-8-12-22-20(16)27-5/h8-12H,6-7,13H2,1-5H3,(H,23,25)/b11-10+