6-methyl-4-methylsulfonyl-N-[3-(2-propoxyphenyl)propyl]-2,3-dihydro-1,4-benzoxazine-2-carboxamide

Systemtic Name: 6-methyl-4-methylsulfonyl-N-[3-(2-propoxyphenyl)propyl]-2,3-dihydro-1,4-benzoxazine-2-carboxamide Openeye Name: 6-methyl-4-methylsulfonyl-N-[3-(2-propoxyphenyl)propyl]-2,3-dihydro-1,4-benzoxazine-2-carboxamide CAS Name: 6-methyl-4-methylsulfonyl-N-[3-(2-propoxyphenyl)propyl]-2,3-dihydro-1,4-benzoxazine-2-carboxamide IUPAC Name: 6-methyl-4-methylsulfonyl-N-[3-(2-propoxyphenyl)propyl]-2,3-dihydro-1,4-benzoxazine-2-carboxamide Traditional Name: 4-mesyl-6-methyl-N-[3-(2-propoxyphenyl)propyl]-2,3-dihydro-1,4-benzoxazine-2-carboxamide Formula: C23H30N2O5S MolecularWeight: 446.5597

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=CC=C1CCCNC(=O)C2CN(C3=C(O2)C=CC(=C3)C)S(=O)(=O)C

Isomeric SMILES

CCCOC1=CC=CC=C1CCCNC(=O)C2CN(C3=C(O2)C=CC(=C3)C)S(=O)(=O)C

InChI

InChI=1S/C23H30N2O5S/c1-4-14-29-20-10-6-5-8-18(20)9-7-13-24-23(26)22-16-25(31(3,27)28)19-15-17(2)11-12-21(19)30-22/h5-6,8,10-12,15,22H,4,7,9,13-14,16H2,1-3H3,(H,24,26)