(2S)-N-methyl-4-[3-(4-methylphenyl)sulfonylpropanoyl]-2,3-dihydro-1,4-benzoxazine-2-carboxamide

Systemtic Name: (2S)-N-methyl-4-[3-(4-methylphenyl)sulfonylpropanoyl]-2,3-dihydro-1,4-benzoxazine-2-carboxamide Openeye Name: (2S)-N-methyl-4-[3-(p-tolylsulfonyl)propanoyl]-2,3-dihydro-1,4-benzoxazine-2-carboxamide CAS Name: (2S)-N-methyl-4-[3-(4-methylphenyl)sulfonyl-1-oxopropyl]-2,3-dihydro-1,4-benzoxazine-2-carboxamide IUPAC Name: (2S)-N-methyl-4-[3-(4-methylphenyl)sulfonylpropanoyl]-2,3-dihydro-1,4-benzoxazine-2-carboxamide Traditional Name: (2S)-N-methyl-4-(3-tosylpropanoyl)-2,3-dihydro-1,4-benzoxazine-2-carboxamide Formula: C20H22N2O5S MolecularWeight: 402.46408

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)CCC(=O)N2CC(OC3=CC=CC=C32)C(=O)NC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)CCC(=O)N2C[C@H](OC3=CC=CC=C32)C(=O)NC

InChI

InChI=1S/C20H22N2O5S/c1-14-7-9-15(10-8-14)28(25,26)12-11-19(23)22-13-18(20(24)21-2)27-17-6-4-3-5-16(17)22/h3-10,18H,11-13H2,1-2H3,(H,21,24)/t18-/m0/s1