N-[1-(4-methoxyphenyl)-3-methyl-butyl]-4-methylsulfonyl-2,3-dihydro-1,4-benzoxazine-2-carboxamide

Systemtic Name: N-[1-(4-methoxyphenyl)-3-methyl-butyl]-4-methylsulfonyl-2,3-dihydro-1,4-benzoxazine-2-carboxamide Openeye Name: N-[1-(4-methoxyphenyl)-3-methyl-butyl]-4-methylsulfonyl-2,3-dihydro-1,4-benzoxazine-2-carboxamide CAS Name: N-[1-(4-methoxyphenyl)-3-methylbutyl]-4-methylsulfonyl-2,3-dihydro-1,4-benzoxazine-2-carboxamide IUPAC Name: N-[1-(4-methoxyphenyl)-3-methylbutyl]-4-methylsulfonyl-2,3-dihydro-1,4-benzoxazine-2-carboxamide Traditional Name: 4-mesyl-N-[1-(4-methoxyphenyl)-3-methyl-butyl]-2,3-dihydro-1,4-benzoxazine-2-carboxamide Formula: C22H28N2O5S MolecularWeight: 432.53312

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C1=CC=C(C=C1)OC)NC(=O)C2CN(C3=CC=CC=C3O2)S(=O)(=O)C

Isomeric SMILES

CC(C)CC(C1=CC=C(C=C1)OC)NC(=O)C2CN(C3=CC=CC=C3O2)S(=O)(=O)C

InChI

InChI=1S/C22H28N2O5S/c1-15(2)13-18(16-9-11-17(28-3)12-10-16)23-22(25)21-14-24(30(4,26)27)19-7-5-6-8-20(19)29-21/h5-12,15,18,21H,13-14H2,1-4H3,(H,23,25)