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

Systemtic Name: N-[1-(3,4-dimethoxyphenyl)propyl]-6-methyl-4-methylsulfonyl-2,3-dihydro-1,4-benzoxazine-2-carboxamide Openeye Name: N-[1-(3,4-dimethoxyphenyl)propyl]-6-methyl-4-methylsulfonyl-2,3-dihydro-1,4-benzoxazine-2-carboxamide CAS Name: N-[1-(3,4-dimethoxyphenyl)propyl]-6-methyl-4-methylsulfonyl-2,3-dihydro-1,4-benzoxazine-2-carboxamide IUPAC Name: N-[1-(3,4-dimethoxyphenyl)propyl]-6-methyl-4-methylsulfonyl-2,3-dihydro-1,4-benzoxazine-2-carboxamide Traditional Name: N-[1-(3,4-dimethoxyphenyl)propyl]-4-mesyl-6-methyl-2,3-dihydro-1,4-benzoxazine-2-carboxamide Formula: C22H28N2O6S MolecularWeight: 448.53252

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC(=C(C=C1)OC)OC)NC(=O)C2CN(C3=C(O2)C=CC(=C3)C)S(=O)(=O)C

Isomeric SMILES

CCC(C1=CC(=C(C=C1)OC)OC)NC(=O)C2CN(C3=C(O2)C=CC(=C3)C)S(=O)(=O)C

InChI

InChI=1S/C22H28N2O6S/c1-6-16(15-8-10-19(28-3)20(12-15)29-4)23-22(25)21-13-24(31(5,26)27)17-11-14(2)7-9-18(17)30-21/h7-12,16,21H,6,13H2,1-5H3,(H,23,25)