6-[(E)-3-(3-methoxy-2-propan-2-yloxy-phenyl)prop-2-enoyl]-4H-1,4-benzoxazin-3-one

Systemtic Name: 6-[(E)-3-(3-methoxy-2-propan-2-yloxy-phenyl)prop-2-enoyl]-4H-1,4-benzoxazin-3-one Openeye Name: 6-[(E)-3-(2-isopropoxy-3-methoxy-phenyl)prop-2-enoyl]-4H-1,4-benzoxazin-3-one CAS Name: 6-[(E)-3-(3-methoxy-2-propan-2-yloxyphenyl)-1-oxoprop-2-enyl]-4H-1,4-benzoxazin-3-one IUPAC Name: 6-[(E)-3-(3-methoxy-2-propan-2-yloxyphenyl)prop-2-enoyl]-4H-1,4-benzoxazin-3-one Traditional Name: 6-[(E)-3-(2-isopropoxy-3-methoxy-phenyl)acryloyl]-4H-1,4-benzoxazin-3-one Formula: C21H21NO5 MolecularWeight: 367.39514

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=C(C=CC=C1OC)C=CC(=O)C2=CC3=C(C=C2)OCC(=O)N3

Isomeric SMILES

CC(C)OC1=C(C=CC=C1OC)/C=C/C(=O)C2=CC3=C(C=C2)OCC(=O)N3

InChI

InChI=1S/C21H21NO5/c1-13(2)27-21-14(5-4-6-19(21)25-3)7-9-17(23)15-8-10-18-16(11-15)22-20(24)12-26-18/h4-11,13H,12H2,1-3H3,(H,22,24)/b9-7+