2-azanyl-4-(3-bromophenyl)-6,6-dimethyl-5-oxidanylidene-7,8-dihydro-4H-chromene-3-carbonitrile

Systemtic Name: 2-azanyl-4-(3-bromophenyl)-6,6-dimethyl-5-oxidanylidene-7,8-dihydro-4H-chromene-3-carbonitrile Openeye Name: 2-amino-4-(3-bromophenyl)-6,6-dimethyl-5-oxo-7,8-dihydro-4H-chromene-3-carbonitrile CAS Name: 2-amino-4-(3-bromophenyl)-6,6-dimethyl-5-oxo-7,8-dihydro-4H-1-benzopyran-3-carbonitrile IUPAC Name: 2-amino-4-(3-bromophenyl)-6,6-dimethyl-5-oxo-7,8-dihydro-4H-chromene-3-carbonitrile Traditional Name: 2-amino-4-(3-bromophenyl)-5-keto-6,6-dimethyl-7,8-dihydro-4H-chromene-3-carbonitrile Formula: C18H17BrN2O2 MolecularWeight: 373.24378

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CCC2=C(C1=O)C(C(=C(O2)N)C#N)C3=CC(=CC=C3)Br)C

Isomeric SMILES

CC1(CCC2=C(C1=O)C(C(=C(O2)N)C#N)C3=CC(=CC=C3)Br)C

InChI

InChI=1S/C18H17BrN2O2/c1-18(2)7-6-13-15(16(18)22)14(12(9-20)17(21)23-13)10-4-3-5-11(19)8-10/h3-5,8,14H,6-7,21H2,1-2H3