N-(1-adamantyl)-4-(4-chlorophenyl)sulfonyl-2,3-dihydro-1,4-benzoxazine-2-carboxamide

Systemtic Name: N-(1-adamantyl)-4-(4-chlorophenyl)sulfonyl-2,3-dihydro-1,4-benzoxazine-2-carboxamide Openeye Name: N-(1-adamantyl)-4-(4-chlorophenyl)sulfonyl-2,3-dihydro-1,4-benzoxazine-2-carboxamide CAS Name: N-(1-adamantyl)-4-(4-chlorophenyl)sulfonyl-2,3-dihydro-1,4-benzoxazine-2-carboxamide IUPAC Name: N-(1-adamantyl)-4-(4-chlorophenyl)sulfonyl-2,3-dihydro-1,4-benzoxazine-2-carboxamide Traditional Name: N-(1-adamantyl)-4-(4-chlorophenyl)sulfonyl-2,3-dihydro-1,4-benzoxazine-2-carboxamide Formula: C25H27ClN2O4S MolecularWeight: 487.01088

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)NC(=O)C4CN(C5=CC=CC=C5O4)S(=O)(=O)C6=CC=C(C=C6)Cl

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)NC(=O)C4CN(C5=CC=CC=C5O4)S(=O)(=O)C6=CC=C(C=C6)Cl

InChI

InChI=1S/C25H27ClN2O4S/c26-19-5-7-20(8-6-19)33(30,31)28-15-23(32-22-4-2-1-3-21(22)28)24(29)27-25-12-16-9-17(13-25)11-18(10-16)14-25/h1-8,16-18,23H,9-15H2,(H,27,29)