methyl 4-[(E)-3-[(6-morpholin-4-ylpyridin-3-yl)amino]-3-oxidanylidene-prop-1-enyl]benzoate

Systemtic Name: methyl 4-[(E)-3-[(6-morpholin-4-ylpyridin-3-yl)amino]-3-oxidanylidene-prop-1-enyl]benzoate Openeye Name: methyl 4-[(E)-3-[(6-morpholino-3-pyridyl)amino]-3-oxo-prop-1-enyl]benzoate CAS Name: 4-[(E)-3-[[6-(4-morpholinyl)-3-pyridinyl]amino]-3-oxoprop-1-enyl]benzoic acid methyl ester IUPAC Name: methyl 4-[(E)-3-[(6-morpholin-4-ylpyridin-3-yl)amino]-3-oxoprop-1-enyl]benzoate Traditional Name: 4-[(E)-3-keto-3-[(6-morpholino-3-pyridyl)amino]prop-1-enyl]benzoic acid methyl ester Formula: C20H21N3O4 MolecularWeight: 367.39844

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)C=CC(=O)NC2=CN=C(C=C2)N3CCOCC3

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)/C=C/C(=O)NC2=CN=C(C=C2)N3CCOCC3

InChI

InChI=1S/C20H21N3O4/c1-26-20(25)16-5-2-15(3-6-16)4-9-19(24)22-17-7-8-18(21-14-17)23-10-12-27-13-11-23/h2-9,14H,10-13H2,1H3,(H,22,24)/b9-4+