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

Systemtic Name: 2-azanyl-4-[3-(2,3-dihydroindol-1-ylmethyl)-2,5-dimethyl-phenyl]-5-oxidanylidene-4,6,7,8-tetrahydrochromene-3-carbonitrile Openeye Name: 2-amino-4-[3-(indolin-1-ylmethyl)-2,5-dimethyl-phenyl]-5-oxo-4,6,7,8-tetrahydrochromene-3-carbonitrile CAS Name: 2-amino-4-[3-(2,3-dihydroindol-1-ylmethyl)-2,5-dimethylphenyl]-5-oxo-4,6,7,8-tetrahydro-1-benzopyran-3-carbonitrile IUPAC Name: 2-amino-4-[3-(2,3-dihydroindol-1-ylmethyl)-2,5-dimethylphenyl]-5-oxo-4,6,7,8-tetrahydrochromene-3-carbonitrile Traditional Name: 2-amino-4-[3-(indolin-1-ylmethyl)-2,5-dimethyl-phenyl]-5-keto-4,6,7,8-tetrahydrochromene-3-carbonitrile Formula: C27H27N3O2 MolecularWeight: 425.52218

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C2C(=C(OC3=C2C(=O)CCC3)N)C#N)C)CN4CCC5=CC=CC=C54

Isomeric SMILES

CC1=CC(=C(C(=C1)C2C(=C(OC3=C2C(=O)CCC3)N)C#N)C)CN4CCC5=CC=CC=C54

InChI

InChI=1S/C27H27N3O2/c1-16-12-19(15-30-11-10-18-6-3-4-7-22(18)30)17(2)20(13-16)25-21(14-28)27(29)32-24-9-5-8-23(31)26(24)25/h3-4,6-7,12-13,25H,5,8-11,15,29H2,1-2H3