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

Systemtic Name: (4R,7R)-2-azanyl-4-(2-methylpropyl)-5-oxidanylidene-7-phenyl-4,6,7,8-tetrahydrochromene-3-carbonitrile Openeye Name: (4R,7R)-2-amino-4-isobutyl-5-oxo-7-phenyl-4,6,7,8-tetrahydrochromene-3-carbonitrile CAS Name: (4R,7R)-2-amino-4-(2-methylpropyl)-5-oxo-7-phenyl-4,6,7,8-tetrahydro-1-benzopyran-3-carbonitrile IUPAC Name: (4R,7R)-2-amino-4-(2-methylpropyl)-5-oxo-7-phenyl-4,6,7,8-tetrahydrochromene-3-carbonitrile Traditional Name: (4R,7R)-2-amino-4-isobutyl-5-keto-7-phenyl-4,6,7,8-tetrahydrochromene-3-carbonitrile Formula: C20H22N2O2 MolecularWeight: 322.40088

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1C(=C(OC2=C1C(=O)CC(C2)C3=CC=CC=C3)N)C#N

Isomeric SMILES

CC(C)C[C@@H]1C(=C(OC2=C1C(=O)C[C@@H](C2)C3=CC=CC=C3)N)C#N

InChI

InChI=1S/C20H22N2O2/c1-12(2)8-15-16(11-21)20(22)24-18-10-14(9-17(23)19(15)18)13-6-4-3-5-7-13/h3-7,12,14-15H,8-10,22H2,1-2H3/t14-,15+/m0/s1