2-azanyl-6-ethoxy-7-methyl-5-oxidanylidene-4-(4-prop-2-enoxyphenyl)-4H-oxepine-3-carbonitrile

Systemtic Name: 2-azanyl-6-ethoxy-7-methyl-5-oxidanylidene-4-(4-prop-2-enoxyphenyl)-4H-oxepine-3-carbonitrile Openeye Name: 4-(4-allyloxyphenyl)-2-amino-6-ethoxy-7-methyl-5-oxo-4H-oxepine-3-carbonitrile CAS Name: 2-amino-6-ethoxy-7-methyl-5-oxo-4-(4-prop-2-enoxyphenyl)-4H-oxepin-3-carbonitrile IUPAC Name: 2-amino-6-ethoxy-7-methyl-5-oxo-4-(4-prop-2-enoxyphenyl)-4H-oxepine-3-carbonitrile Traditional Name: 4-(4-allyloxyphenyl)-2-amino-6-ethoxy-5-keto-7-methyl-4H-oxepin-3-carbonitrile Formula: C19H20N2O4 MolecularWeight: 340.3731

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(OC(=C(C(C1=O)C2=CC=C(C=C2)OCC=C)C#N)N)C

Isomeric SMILES

CCOC1=C(OC(=C(C(C1=O)C2=CC=C(C=C2)OCC=C)C#N)N)C

InChI

InChI=1S/C19H20N2O4/c1-4-10-24-14-8-6-13(7-9-14)16-15(11-20)19(21)25-12(3)18(17(16)22)23-5-2/h4,6-9,16H,1,5,10,21H2,2-3H3