2-azanyl-5-oxidanylidene-4-(3-phenylmethoxyphenyl)-4,6,7,8-tetrahydrochromene-3-carbonitrile

Systemtic Name: 2-azanyl-5-oxidanylidene-4-(3-phenylmethoxyphenyl)-4,6,7,8-tetrahydrochromene-3-carbonitrile Openeye Name: 2-amino-4-(3-benzyloxyphenyl)-5-oxo-4,6,7,8-tetrahydrochromene-3-carbonitrile CAS Name: 2-amino-5-oxo-4-(3-phenylmethoxyphenyl)-4,6,7,8-tetrahydro-1-benzopyran-3-carbonitrile IUPAC Name: 2-amino-5-oxo-4-(3-phenylmethoxyphenyl)-4,6,7,8-tetrahydrochromene-3-carbonitrile Traditional Name: 2-amino-4-(3-benzoxyphenyl)-5-keto-4,6,7,8-tetrahydrochromene-3-carbonitrile Formula: C23H20N2O3 MolecularWeight: 372.4165

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C(C(=C(O2)N)C#N)C3=CC(=CC=C3)OCC4=CC=CC=C4)C(=O)C1

Isomeric SMILES

C1CC2=C(C(C(=C(O2)N)C#N)C3=CC(=CC=C3)OCC4=CC=CC=C4)C(=O)C1

InChI

InChI=1S/C23H20N2O3/c24-13-18-21(22-19(26)10-5-11-20(22)28-23(18)25)16-8-4-9-17(12-16)27-14-15-6-2-1-3-7-15/h1-4,6-9,12,21H,5,10-11,14,25H2