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

Systemtic Name: 2-azanyl-4-[1-[(4-chlorophenyl)methyl]indol-3-yl]-7,7-dimethyl-5-oxidanylidene-6,8-dihydro-4H-chromene-3-carbonitrile Openeye Name: 2-amino-4-[1-[(4-chlorophenyl)methyl]indol-3-yl]-7,7-dimethyl-5-oxo-6,8-dihydro-4H-chromene-3-carbonitrile CAS Name: 2-amino-4-[1-[(4-chlorophenyl)methyl]-3-indolyl]-7,7-dimethyl-5-oxo-6,8-dihydro-4H-1-benzopyran-3-carbonitrile IUPAC Name: 2-amino-4-[1-[(4-chlorophenyl)methyl]indol-3-yl]-7,7-dimethyl-5-oxo-6,8-dihydro-4H-chromene-3-carbonitrile Traditional Name: 2-amino-4-[1-(4-chlorobenzyl)indol-3-yl]-5-keto-7,7-dimethyl-6,8-dihydro-4H-chromene-3-carbonitrile Formula: C27H24ClN3O2 MolecularWeight: 457.95136

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=CC=CC=C43)CC5=CC=C(C=C5)Cl)C(=O)C1)C

Isomeric SMILES

CC1(CC2=C(C(C(=C(O2)N)C#N)C3=CN(C4=CC=CC=C43)CC5=CC=C(C=C5)Cl)C(=O)C1)C

InChI

InChI=1S/C27H24ClN3O2/c1-27(2)11-22(32)25-23(12-27)33-26(30)19(13-29)24(25)20-15-31(21-6-4-3-5-18(20)21)14-16-7-9-17(28)10-8-16/h3-10,15,24H,11-12,14,30H2,1-2H3