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

Systemtic Name: 2-azanyl-7,7-dimethyl-4-(3-nitrophenyl)-5-oxidanylidene-6,8-dihydro-4H-cyclopenta[b]oxepine-3-carbonitrile Openeye Name: 2-amino-7,7-dimethyl-4-(3-nitrophenyl)-5-oxo-6,8-dihydro-4H-cyclopenta[b]oxepine-3-carbonitrile CAS Name: 2-amino-7,7-dimethyl-4-(3-nitrophenyl)-5-oxo-6,8-dihydro-4H-cyclopenta[b]oxepin-3-carbonitrile IUPAC Name: 2-amino-7,7-dimethyl-4-(3-nitrophenyl)-5-oxo-6,8-dihydro-4H-cyclopenta[b]oxepine-3-carbonitrile Traditional Name: 2-amino-5-keto-7,7-dimethyl-4-(3-nitrophenyl)-6,8-dihydro-4H-cyclopenta[b]oxepin-3-carbonitrile Formula: C18H17N3O4 MolecularWeight: 339.34528

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2=C(C1)OC(=C(C(C2=O)C3=CC(=CC=C3)[N+](=O)[O-])C#N)N)C

Isomeric SMILES

CC1(CC2=C(C1)OC(=C(C(C2=O)C3=CC(=CC=C3)[N+](=O)[O-])C#N)N)C

InChI

InChI=1S/C18H17N3O4/c1-18(2)7-12-14(8-18)25-17(20)13(9-19)15(16(12)22)10-4-3-5-11(6-10)21(23)24/h3-6,15H,7-8,20H2,1-2H3