(E)-3-azanyl-2-[2-(4,8-dimethyl-2-oxidanylidene-chromen-7-yl)oxyethanoyl]but-2-enenitrile

Systemtic Name: (E)-3-azanyl-2-[2-(4,8-dimethyl-2-oxidanylidene-chromen-7-yl)oxyethanoyl]but-2-enenitrile Openeye Name: (E)-3-amino-2-[2-(4,8-dimethyl-2-oxo-chromen-7-yl)oxyacetyl]but-2-enenitrile CAS Name: (E)-3-amino-2-[2-[(4,8-dimethyl-2-oxo-1-benzopyran-7-yl)oxy]-1-oxoethyl]-2-butenenitrile IUPAC Name: (E)-3-amino-2-[2-(4,8-dimethyl-2-oxochromen-7-yl)oxyacetyl]but-2-enenitrile Traditional Name: (E)-3-amino-2-[2-(2-keto-4,8-dimethyl-chromen-7-yl)oxyacetyl]but-2-enenitrile Formula: C17H16N2O4 MolecularWeight: 312.31994

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)OC2=C1C=CC(=C2C)OCC(=O)C(=C(C)N)C#N

Isomeric SMILES

CC1=CC(=O)OC2=C1C=CC(=C2C)OCC(=O)/C(=C(\C)/N)/C#N

InChI

InChI=1S/C17H16N2O4/c1-9-6-16(21)23-17-10(2)15(5-4-12(9)17)22-8-14(20)13(7-18)11(3)19/h4-6H,8,19H2,1-3H3/b13-11+