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

Systemtic Name: N-[4-(1-adamantyl)phenyl]-4-(4-chlorophenyl)sulfonyl-2,3-dihydro-1,4-benzoxazine-2-carboxamide Openeye Name: N-[4-(1-adamantyl)phenyl]-4-(4-chlorophenyl)sulfonyl-2,3-dihydro-1,4-benzoxazine-2-carboxamide CAS Name: N-[4-(1-adamantyl)phenyl]-4-(4-chlorophenyl)sulfonyl-2,3-dihydro-1,4-benzoxazine-2-carboxamide IUPAC Name: N-[4-(1-adamantyl)phenyl]-4-(4-chlorophenyl)sulfonyl-2,3-dihydro-1,4-benzoxazine-2-carboxamide Traditional Name: N-[4-(1-adamantyl)phenyl]-4-(4-chlorophenyl)sulfonyl-2,3-dihydro-1,4-benzoxazine-2-carboxamide Formula: C31H31ClN2O4S MolecularWeight: 563.10684

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)C4=CC=C(C=C4)NC(=O)C5CN(C6=CC=CC=C6O5)S(=O)(=O)C7=CC=C(C=C7)Cl

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)C4=CC=C(C=C4)NC(=O)C5CN(C6=CC=CC=C6O5)S(=O)(=O)C7=CC=C(C=C7)Cl

InChI

InChI=1S/C31H31ClN2O4S/c32-24-7-11-26(12-8-24)39(36,37)34-19-29(38-28-4-2-1-3-27(28)34)30(35)33-25-9-5-23(6-10-25)31-16-20-13-21(17-31)15-22(14-20)18-31/h1-12,20-22,29H,13-19H2,(H,33,35)