2-[(3-ethynylphenyl)amino]-4-(2,6,6-trimethyl-4-oxidanylidene-5,7-dihydroindol-1-yl)benzamide

Systemtic Name: 2-[(3-ethynylphenyl)amino]-4-(2,6,6-trimethyl-4-oxidanylidene-5,7-dihydroindol-1-yl)benzamide Openeye Name: 2-(3-ethynylanilino)-4-(2,6,6-trimethyl-4-oxo-5,7-dihydroindol-1-yl)benzamide CAS Name: 2-(3-ethynylanilino)-4-(2,6,6-trimethyl-4-oxo-5,7-dihydroindol-1-yl)benzamide IUPAC Name: 2-(3-ethynylanilino)-4-(2,6,6-trimethyl-4-oxo-5,7-dihydroindol-1-yl)benzamide Traditional Name: 2-(3-ethynylanilino)-4-(4-keto-2,6,6-trimethyl-5,7-dihydroindol-1-yl)benzamide Formula: C26H25N3O2 MolecularWeight: 411.4956

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(N1C3=CC(=C(C=C3)C(=O)N)NC4=CC=CC(=C4)C#C)CC(CC2=O)(C)C

Isomeric SMILES

CC1=CC2=C(N1C3=CC(=C(C=C3)C(=O)N)NC4=CC=CC(=C4)C#C)CC(CC2=O)(C)C

InChI

InChI=1S/C26H25N3O2/c1-5-17-7-6-8-18(12-17)28-22-13-19(9-10-20(22)25(27)31)29-16(2)11-21-23(29)14-26(3,4)15-24(21)30/h1,6-13,28H,14-15H2,2-4H3,(H2,27,31)