4-methylsulfonyl-N-[3-(4-propan-2-yloxyphenyl)propyl]-2,3-dihydro-1,4-benzoxazine-2-carboxamide

Systemtic Name: 4-methylsulfonyl-N-[3-(4-propan-2-yloxyphenyl)propyl]-2,3-dihydro-1,4-benzoxazine-2-carboxamide Openeye Name: N-[3-(4-isopropoxyphenyl)propyl]-4-methylsulfonyl-2,3-dihydro-1,4-benzoxazine-2-carboxamide CAS Name: 4-methylsulfonyl-N-[3-(4-propan-2-yloxyphenyl)propyl]-2,3-dihydro-1,4-benzoxazine-2-carboxamide IUPAC Name: 4-methylsulfonyl-N-[3-(4-propan-2-yloxyphenyl)propyl]-2,3-dihydro-1,4-benzoxazine-2-carboxamide Traditional Name: N-[3-(4-isopropoxyphenyl)propyl]-4-mesyl-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)OC1=CC=C(C=C1)CCCNC(=O)C2CN(C3=CC=CC=C3O2)S(=O)(=O)C

Isomeric SMILES

CC(C)OC1=CC=C(C=C1)CCCNC(=O)C2CN(C3=CC=CC=C3O2)S(=O)(=O)C

InChI

InChI=1S/C22H28N2O5S/c1-16(2)28-18-12-10-17(11-13-18)7-6-14-23-22(25)21-15-24(30(3,26)27)19-8-4-5-9-20(19)29-21/h4-5,8-13,16,21H,6-7,14-15H2,1-3H3,(H,23,25)