2-azanyl-4-[3-(2,3-dihydroindol-1-ylmethyl)-2,5-dimethyl-phenyl]-7,7-dimethyl-5-oxidanylidene-6,8-dihydro-4H-chromene-3-carbonitrile

Systemtic Name: 2-azanyl-4-[3-(2,3-dihydroindol-1-ylmethyl)-2,5-dimethyl-phenyl]-7,7-dimethyl-5-oxidanylidene-6,8-dihydro-4H-chromene-3-carbonitrile Openeye Name: 2-amino-4-[3-(indolin-1-ylmethyl)-2,5-dimethyl-phenyl]-7,7-dimethyl-5-oxo-6,8-dihydro-4H-chromene-3-carbonitrile CAS Name: 2-amino-4-[3-(2,3-dihydroindol-1-ylmethyl)-2,5-dimethylphenyl]-7,7-dimethyl-5-oxo-6,8-dihydro-4H-1-benzopyran-3-carbonitrile IUPAC Name: 2-amino-4-[3-(2,3-dihydroindol-1-ylmethyl)-2,5-dimethylphenyl]-7,7-dimethyl-5-oxo-6,8-dihydro-4H-chromene-3-carbonitrile Traditional Name: 2-amino-4-[3-(indolin-1-ylmethyl)-2,5-dimethyl-phenyl]-5-keto-7,7-dimethyl-6,8-dihydro-4H-chromene-3-carbonitrile Formula: C29H31N3O2 MolecularWeight: 453.57534

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C2C(=C(OC3=C2C(=O)CC(C3)(C)C)N)C#N)C)CN4CCC5=CC=CC=C54

Isomeric SMILES

CC1=CC(=C(C(=C1)C2C(=C(OC3=C2C(=O)CC(C3)(C)C)N)C#N)C)CN4CCC5=CC=CC=C54

InChI

InChI=1S/C29H31N3O2/c1-17-11-20(16-32-10-9-19-7-5-6-8-23(19)32)18(2)21(12-17)26-22(15-30)28(31)34-25-14-29(3,4)13-24(33)27(25)26/h5-8,11-12,26H,9-10,13-14,16,31H2,1-4H3