2-azanyl-7,7-dimethyl-5-oxidanylidene-4-(4-prop-2-enoxyphenyl)-6,8-dihydro-4H-cyclopenta[b]oxepine-3-carbonitrile

Systemtic Name: 2-azanyl-7,7-dimethyl-5-oxidanylidene-4-(4-prop-2-enoxyphenyl)-6,8-dihydro-4H-cyclopenta[b]oxepine-3-carbonitrile Openeye Name: 4-(4-allyloxyphenyl)-2-amino-7,7-dimethyl-5-oxo-6,8-dihydro-4H-cyclopenta[b]oxepine-3-carbonitrile CAS Name: 2-amino-7,7-dimethyl-5-oxo-4-(4-prop-2-enoxyphenyl)-6,8-dihydro-4H-cyclopenta[b]oxepin-3-carbonitrile IUPAC Name: 2-amino-7,7-dimethyl-5-oxo-4-(4-prop-2-enoxyphenyl)-6,8-dihydro-4H-cyclopenta[b]oxepine-3-carbonitrile Traditional Name: 4-(4-allyloxyphenyl)-2-amino-5-keto-7,7-dimethyl-6,8-dihydro-4H-cyclopenta[b]oxepin-3-carbonitrile Formula: C21H22N2O3 MolecularWeight: 350.41098

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2=C(C1)OC(=C(C(C2=O)C3=CC=C(C=C3)OCC=C)C#N)N)C

Isomeric SMILES

CC1(CC2=C(C1)OC(=C(C(C2=O)C3=CC=C(C=C3)OCC=C)C#N)N)C

InChI

InChI=1S/C21H22N2O3/c1-4-9-25-14-7-5-13(6-8-14)18-16(12-22)20(23)26-17-11-21(2,3)10-15(17)19(18)24/h4-8,18H,1,9-11,23H2,2-3H3