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

Systemtic Name: (4R)-2-azanyl-5-oxidanylidene-4-phenethyl-4,6,7,8-tetrahydrochromene-3-carbonitrile Openeye Name: (4R)-2-amino-5-oxo-4-phenethyl-4,6,7,8-tetrahydrochromene-3-carbonitrile CAS Name: (4R)-2-amino-5-oxo-4-phenethyl-4,6,7,8-tetrahydro-1-benzopyran-3-carbonitrile IUPAC Name: (4R)-2-amino-5-oxo-4-phenethyl-4,6,7,8-tetrahydrochromene-3-carbonitrile Traditional Name: (4R)-2-amino-5-keto-4-phenethyl-4,6,7,8-tetrahydrochromene-3-carbonitrile Formula: C18H18N2O2 MolecularWeight: 294.34772

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C(C(=C(O2)N)C#N)CCC3=CC=CC=C3)C(=O)C1

Isomeric SMILES

C1CC2=C([C@@H](C(=C(O2)N)C#N)CCC3=CC=CC=C3)C(=O)C1

InChI

InChI=1S/C18H18N2O2/c19-11-14-13(10-9-12-5-2-1-3-6-12)17-15(21)7-4-8-16(17)22-18(14)20/h1-3,5-6,13H,4,7-10,20H2/t13-/m1/s1