N-(5-methylsulfonyl-2-adamantyl)-2,3-dihydro-1,4-benzoxazine-4-carboxamide

Systemtic Name: N-(5-methylsulfonyl-2-adamantyl)-2,3-dihydro-1,4-benzoxazine-4-carboxamide Openeye Name: N-(5-methylsulfonyl-2-adamantyl)-2,3-dihydro-1,4-benzoxazine-4-carboxamide CAS Name: N-(5-methylsulfonyl-2-adamantyl)-2,3-dihydro-1,4-benzoxazine-4-carboxamide IUPAC Name: N-(5-methylsulfonyl-2-adamantyl)-2,3-dihydro-1,4-benzoxazine-4-carboxamide Traditional Name: N-(5-mesyl-2-adamantyl)-2,3-dihydro-1,4-benzoxazine-4-carboxamide Formula: C20H26N2O4S MolecularWeight: 390.49644

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C12CC3CC(C1)C(C(C3)C2)NC(=O)N4CCOC5=CC=CC=C54

Isomeric SMILES

CS(=O)(=O)C12CC3CC(C1)C(C(C3)C2)NC(=O)N4CCOC5=CC=CC=C54

InChI

InChI=1S/C20H26N2O4S/c1-27(24,25)20-10-13-8-14(11-20)18(15(9-13)12-20)21-19(23)22-6-7-26-17-5-3-2-4-16(17)22/h2-5,13-15,18H,6-12H2,1H3,(H,21,23)