2-azanyl-4-[5-bromanyl-1-(phenylmethyl)indol-3-yl]-7,7-dimethyl-5-oxidanylidene-6,8-dihydro-4H-chromene-3-carbonitrile

Systemtic Name: 2-azanyl-4-[5-bromanyl-1-(phenylmethyl)indol-3-yl]-7,7-dimethyl-5-oxidanylidene-6,8-dihydro-4H-chromene-3-carbonitrile Openeye Name: 2-amino-4-(1-benzyl-5-bromo-indol-3-yl)-7,7-dimethyl-5-oxo-6,8-dihydro-4H-chromene-3-carbonitrile CAS Name: 2-amino-4-[5-bromo-1-(phenylmethyl)-3-indolyl]-7,7-dimethyl-5-oxo-6,8-dihydro-4H-1-benzopyran-3-carbonitrile IUPAC Name: 2-amino-4-(1-benzyl-5-bromoindol-3-yl)-7,7-dimethyl-5-oxo-6,8-dihydro-4H-chromene-3-carbonitrile Traditional Name: 2-amino-4-(1-benzyl-5-bromo-indol-3-yl)-5-keto-7,7-dimethyl-6,8-dihydro-4H-chromene-3-carbonitrile Formula: C27H24BrN3O2 MolecularWeight: 502.40236

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2=C(C(C(=C(O2)N)C#N)C3=CN(C4=C3C=C(C=C4)Br)CC5=CC=CC=C5)C(=O)C1)C

Isomeric SMILES

CC1(CC2=C(C(C(=C(O2)N)C#N)C3=CN(C4=C3C=C(C=C4)Br)CC5=CC=CC=C5)C(=O)C1)C

InChI

InChI=1S/C27H24BrN3O2/c1-27(2)11-22(32)25-23(12-27)33-26(30)19(13-29)24(25)20-15-31(14-16-6-4-3-5-7-16)21-9-8-17(28)10-18(20)21/h3-10,15,24H,11-12,14,30H2,1-2H3