2-azanyl-7-methyl-5-oxidanylidene-4-phenyl-6-phenylmethoxy-4H-oxepine-3-carbonitrile

Systemtic Name: 2-azanyl-7-methyl-5-oxidanylidene-4-phenyl-6-phenylmethoxy-4H-oxepine-3-carbonitrile Openeye Name: 2-amino-6-benzyloxy-7-methyl-5-oxo-4-phenyl-4H-oxepine-3-carbonitrile CAS Name: 2-amino-7-methyl-5-oxo-4-phenyl-6-phenylmethoxy-4H-oxepin-3-carbonitrile IUPAC Name: 2-amino-7-methyl-5-oxo-4-phenyl-6-phenylmethoxy-4H-oxepine-3-carbonitrile Traditional Name: 2-amino-6-benzoxy-5-keto-7-methyl-4-phenyl-4H-oxepin-3-carbonitrile Formula: C21H18N2O3 MolecularWeight: 346.37922

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)C(C(=C(O1)N)C#N)C2=CC=CC=C2)OCC3=CC=CC=C3

Isomeric SMILES

CC1=C(C(=O)C(C(=C(O1)N)C#N)C2=CC=CC=C2)OCC3=CC=CC=C3

InChI

InChI=1S/C21H18N2O3/c1-14-20(25-13-15-8-4-2-5-9-15)19(24)18(16-10-6-3-7-11-16)17(12-22)21(23)26-14/h2-11,18H,13,23H2,1H3