(E)-3-(3-ethoxy-4-methoxy-phenyl)-3-(4-methyl-2,3-dihydro-1,4-benzoxazin-7-yl)prop-2-enenitrile

Systemtic Name: (E)-3-(3-ethoxy-4-methoxy-phenyl)-3-(4-methyl-2,3-dihydro-1,4-benzoxazin-7-yl)prop-2-enenitrile Openeye Name: (E)-3-(3-ethoxy-4-methoxy-phenyl)-3-(4-methyl-2,3-dihydro-1,4-benzoxazin-7-yl)prop-2-enenitrile CAS Name: (E)-3-(3-ethoxy-4-methoxyphenyl)-3-(4-methyl-2,3-dihydro-1,4-benzoxazin-7-yl)-2-propenenitrile IUPAC Name: (E)-3-(3-ethoxy-4-methoxyphenyl)-3-(4-methyl-2,3-dihydro-1,4-benzoxazin-7-yl)prop-2-enenitrile Traditional Name: (E)-3-(3-ethoxy-4-methoxy-phenyl)-3-(4-methyl-2,3-dihydro-1,4-benzoxazin-7-yl)acrylonitrile Formula: C21H22N2O3 MolecularWeight: 350.41098

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C(=CC#N)C2=CC3=C(C=C2)N(CCO3)C)OC

Isomeric SMILES

CCOC1=C(C=CC(=C1)/C(=C/C#N)/C2=CC3=C(C=C2)N(CCO3)C)OC

InChI

InChI=1S/C21H22N2O3/c1-4-25-21-14-16(6-8-19(21)24-3)17(9-10-22)15-5-7-18-20(13-15)26-12-11-23(18)2/h5-9,13-14H,4,11-12H2,1-3H3/b17-9+