(E)-4-(7-methyl-2-propan-2-yl-2,3-dihydro-1,4-benzoxazin-4-yl)-4-oxidanylidene-but-2-enoic acid

Systemtic Name: (E)-4-(7-methyl-2-propan-2-yl-2,3-dihydro-1,4-benzoxazin-4-yl)-4-oxidanylidene-but-2-enoic acid Openeye Name: (E)-4-(2-isopropyl-7-methyl-2,3-dihydro-1,4-benzoxazin-4-yl)-4-oxo-but-2-enoic acid CAS Name: (E)-4-(7-methyl-2-propan-2-yl-2,3-dihydro-1,4-benzoxazin-4-yl)-4-oxo-2-butenoic acid IUPAC Name: (E)-4-(7-methyl-2-propan-2-yl-2,3-dihydro-1,4-benzoxazin-4-yl)-4-oxobut-2-enoic acid Traditional Name: (E)-4-(2-isopropyl-7-methyl-2,3-dihydro-1,4-benzoxazin-4-yl)-4-keto-but-2-enoic acid Formula: C16H19NO4 MolecularWeight: 289.32636

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N(CC(O2)C(C)C)C(=O)C=CC(=O)O

Isomeric SMILES

CC1=CC2=C(C=C1)N(CC(O2)C(C)C)C(=O)/C=C/C(=O)O

InChI

InChI=1S/C16H19NO4/c1-10(2)14-9-17(15(18)6-7-16(19)20)12-5-4-11(3)8-13(12)21-14/h4-8,10,14H,9H2,1-3H3,(H,19,20)/b7-6+