N-(1-ethanoyl-2,2,4-trimethyl-4-phenyl-3H-quinolin-6-yl)-4-iodanyl-benzamide

Systemtic Name: N-(1-ethanoyl-2,2,4-trimethyl-4-phenyl-3H-quinolin-6-yl)-4-iodanyl-benzamide Openeye Name: N-(1-acetyl-2,2,4-trimethyl-4-phenyl-3H-quinolin-6-yl)-4-iodo-benzamide CAS Name: N-(1-acetyl-2,2,4-trimethyl-4-phenyl-3H-quinolin-6-yl)-4-iodobenzamide IUPAC Name: N-(1-acetyl-2,2,4-trimethyl-4-phenyl-3H-quinolin-6-yl)-4-iodobenzamide Traditional Name: N-(1-acetyl-2,2,4-trimethyl-4-phenyl-3H-quinolin-6-yl)-4-iodo-benzamide Formula: C27H27IN2O2 MolecularWeight: 538.41995

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1C2=C(C=C(C=C2)NC(=O)C3=CC=C(C=C3)I)C(CC1(C)C)(C)C4=CC=CC=C4

Isomeric SMILES

CC(=O)N1C2=C(C=C(C=C2)NC(=O)C3=CC=C(C=C3)I)C(CC1(C)C)(C)C4=CC=CC=C4

InChI

InChI=1S/C27H27IN2O2/c1-18(31)30-24-15-14-22(29-25(32)19-10-12-21(28)13-11-19)16-23(24)27(4,17-26(30,2)3)20-8-6-5-7-9-20/h5-16H,17H2,1-4H3,(H,29,32)