(E)-4-(6,8-dimethyl-2-phenyl-2,3-dihydro-1,4-benzoxazin-4-yl)-4-oxidanylidene-but-2-enoic acid

Systemtic Name: (E)-4-(6,8-dimethyl-2-phenyl-2,3-dihydro-1,4-benzoxazin-4-yl)-4-oxidanylidene-but-2-enoic acid Openeye Name: (E)-4-(6,8-dimethyl-2-phenyl-2,3-dihydro-1,4-benzoxazin-4-yl)-4-oxo-but-2-enoic acid CAS Name: (E)-4-(6,8-dimethyl-2-phenyl-2,3-dihydro-1,4-benzoxazin-4-yl)-4-oxo-2-butenoic acid IUPAC Name: (E)-4-(6,8-dimethyl-2-phenyl-2,3-dihydro-1,4-benzoxazin-4-yl)-4-oxobut-2-enoic acid Traditional Name: (E)-4-(6,8-dimethyl-2-phenyl-2,3-dihydro-1,4-benzoxazin-4-yl)-4-keto-but-2-enoic acid Formula: C20H19NO4 MolecularWeight: 337.36916

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=C1)N(CC(O2)C3=CC=CC=C3)C(=O)C=CC(=O)O)C

Isomeric SMILES

CC1=CC(=C2C(=C1)N(CC(O2)C3=CC=CC=C3)C(=O)/C=C/C(=O)O)C

InChI

InChI=1S/C20H19NO4/c1-13-10-14(2)20-16(11-13)21(18(22)8-9-19(23)24)12-17(25-20)15-6-4-3-5-7-15/h3-11,17H,12H2,1-2H3,(H,23,24)/b9-8+