(4R)-4-(3-methoxy-4-propoxy-phenyl)-2,7,7-trimethyl-5-oxidanylidene-3,4,6,8-tetrahydroquinoline-3-carbonitrile

Systemtic Name: (4R)-4-(3-methoxy-4-propoxy-phenyl)-2,7,7-trimethyl-5-oxidanylidene-3,4,6,8-tetrahydroquinoline-3-carbonitrile Openeye Name: (4R)-4-(3-methoxy-4-propoxy-phenyl)-2,7,7-trimethyl-5-oxo-3,4,6,8-tetrahydroquinoline-3-carbonitrile CAS Name: (4R)-4-(3-methoxy-4-propoxyphenyl)-2,7,7-trimethyl-5-oxo-3,4,6,8-tetrahydroquinoline-3-carbonitrile IUPAC Name: (4R)-4-(3-methoxy-4-propoxyphenyl)-2,7,7-trimethyl-5-oxo-3,4,6,8-tetrahydroquinoline-3-carbonitrile Traditional Name: (4R)-5-keto-4-(3-methoxy-4-propoxy-phenyl)-2,7,7-trimethyl-3,4,6,8-tetrahydroquinoline-3-carbonitrile Formula: C23H28N2O3 MolecularWeight: 380.48002

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1)C2C(C(=NC3=C2C(=O)CC(C3)(C)C)C)C#N)OC

Isomeric SMILES

CCCOC1=C(C=C(C=C1)[C@H]2C(C(=NC3=C2C(=O)CC(C3)(C)C)C)C#N)OC

InChI

InChI=1S/C23H28N2O3/c1-6-9-28-19-8-7-15(10-20(19)27-5)21-16(13-24)14(2)25-17-11-23(3,4)12-18(26)22(17)21/h7-8,10,16,21H,6,9,11-12H2,1-5H3/t16?,21-/m0/s1