2-azanyl-6-ethoxy-5-oxidanylidene-4-phenyl-7-propyl-4H-oxepine-3-carbonitrile

Systemtic Name: 2-azanyl-6-ethoxy-5-oxidanylidene-4-phenyl-7-propyl-4H-oxepine-3-carbonitrile Openeye Name: 2-amino-6-ethoxy-5-oxo-4-phenyl-7-propyl-4H-oxepine-3-carbonitrile CAS Name: 2-amino-6-ethoxy-5-oxo-4-phenyl-7-propyl-4H-oxepin-3-carbonitrile IUPAC Name: 2-amino-6-ethoxy-5-oxo-4-phenyl-7-propyl-4H-oxepine-3-carbonitrile Traditional Name: 2-amino-6-ethoxy-5-keto-4-phenyl-7-propyl-4H-oxepin-3-carbonitrile Formula: C18H20N2O3 MolecularWeight: 312.363

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C(=O)C(C(=C(O1)N)C#N)C2=CC=CC=C2)OCC

Isomeric SMILES

CCCC1=C(C(=O)C(C(=C(O1)N)C#N)C2=CC=CC=C2)OCC

InChI

InChI=1S/C18H20N2O3/c1-3-8-14-17(22-4-2)16(21)15(12-9-6-5-7-10-12)13(11-19)18(20)23-14/h5-7,9-10,15H,3-4,8,20H2,1-2H3