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

Systemtic Name: 2-azanyl-4-(2-bromanyl-4-butoxy-5-methoxy-phenyl)-7,7-dimethyl-5-oxidanylidene-6,8-dihydro-4H-chromene-3-carbonitrile Openeye Name: 2-amino-4-(2-bromo-4-butoxy-5-methoxy-phenyl)-7,7-dimethyl-5-oxo-6,8-dihydro-4H-chromene-3-carbonitrile CAS Name: 2-amino-4-(2-bromo-4-butoxy-5-methoxyphenyl)-7,7-dimethyl-5-oxo-6,8-dihydro-4H-1-benzopyran-3-carbonitrile IUPAC Name: 2-amino-4-(2-bromo-4-butoxy-5-methoxyphenyl)-7,7-dimethyl-5-oxo-6,8-dihydro-4H-chromene-3-carbonitrile Traditional Name: 2-amino-4-(2-bromo-4-butoxy-5-methoxy-phenyl)-5-keto-7,7-dimethyl-6,8-dihydro-4H-chromene-3-carbonitrile Formula: C23H27BrN2O4 MolecularWeight: 475.37548

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=C(C(=C1)Br)C2C(=C(OC3=C2C(=O)CC(C3)(C)C)N)C#N)OC

Isomeric SMILES

CCCCOC1=C(C=C(C(=C1)Br)C2C(=C(OC3=C2C(=O)CC(C3)(C)C)N)C#N)OC

InChI

InChI=1S/C23H27BrN2O4/c1-5-6-7-29-18-9-15(24)13(8-17(18)28-4)20-14(12-25)22(26)30-19-11-23(2,3)10-16(27)21(19)20/h8-9,20H,5-7,10-11,26H2,1-4H3