(4S)-2-azanyl-4-(4-methoxy-2-propoxy-phenyl)-7,7-dimethyl-5-oxidanylidene-6,8-dihydro-4H-chromene-3-carbonitrile

Systemtic Name: (4S)-2-azanyl-4-(4-methoxy-2-propoxy-phenyl)-7,7-dimethyl-5-oxidanylidene-6,8-dihydro-4H-chromene-3-carbonitrile Openeye Name: (4S)-2-amino-4-(4-methoxy-2-propoxy-phenyl)-7,7-dimethyl-5-oxo-6,8-dihydro-4H-chromene-3-carbonitrile CAS Name: (4S)-2-amino-4-(4-methoxy-2-propoxyphenyl)-7,7-dimethyl-5-oxo-6,8-dihydro-4H-1-benzopyran-3-carbonitrile IUPAC Name: (4S)-2-amino-4-(4-methoxy-2-propoxyphenyl)-7,7-dimethyl-5-oxo-6,8-dihydro-4H-chromene-3-carbonitrile Traditional Name: (4S)-2-amino-5-keto-4-(4-methoxy-2-propoxy-phenyl)-7,7-dimethyl-6,8-dihydro-4H-chromene-3-carbonitrile Formula: C22H26N2O4 MolecularWeight: 382.45284

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=CC(=C1)OC)C2C(=C(OC3=C2C(=O)CC(C3)(C)C)N)C#N

Isomeric SMILES

CCCOC1=C(C=CC(=C1)OC)[C@H]2C(=C(OC3=C2C(=O)CC(C3)(C)C)N)C#N

InChI

InChI=1S/C22H26N2O4/c1-5-8-27-17-9-13(26-4)6-7-14(17)19-15(12-23)21(24)28-18-11-22(2,3)10-16(25)20(18)19/h6-7,9,19H,5,8,10-11,24H2,1-4H3/t19-/m0/s1