methyl (E)-3-oxidanylidene-5-[4-(phenylcarbonyl)-2,3-dihydro-1,4-benzoxazin-6-yl]pent-4-enoate

Systemtic Name: methyl (E)-3-oxidanylidene-5-[4-(phenylcarbonyl)-2,3-dihydro-1,4-benzoxazin-6-yl]pent-4-enoate Openeye Name: methyl (E)-5-(4-benzoyl-2,3-dihydro-1,4-benzoxazin-6-yl)-3-oxo-pent-4-enoate CAS Name: (E)-5-(4-benzoyl-2,3-dihydro-1,4-benzoxazin-6-yl)-3-oxo-4-pentenoic acid methyl ester IUPAC Name: methyl (E)-5-(4-benzoyl-2,3-dihydro-1,4-benzoxazin-6-yl)-3-oxopent-4-enoate Traditional Name: (E)-5-(4-benzoyl-2,3-dihydro-1,4-benzoxazin-6-yl)-3-keto-pent-4-enoic acid methyl ester Formula: C21H19NO5 MolecularWeight: 365.37926

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC(=O)C=CC1=CC2=C(C=C1)OCCN2C(=O)C3=CC=CC=C3

Isomeric SMILES

COC(=O)CC(=O)/C=C/C1=CC2=C(C=C1)OCCN2C(=O)C3=CC=CC=C3

InChI

InChI=1S/C21H19NO5/c1-26-20(24)14-17(23)9-7-15-8-10-19-18(13-15)22(11-12-27-19)21(25)16-5-3-2-4-6-16/h2-10,13H,11-12,14H2,1H3/b9-7+