(2S)-4-[4-(3,4-dimethylphenyl)-4-oxidanylidene-butanoyl]-N-methyl-2,3-dihydro-1,4-benzoxazine-2-carboxamide

Systemtic Name: (2S)-4-[4-(3,4-dimethylphenyl)-4-oxidanylidene-butanoyl]-N-methyl-2,3-dihydro-1,4-benzoxazine-2-carboxamide Openeye Name: (2S)-4-[4-(3,4-dimethylphenyl)-4-oxo-butanoyl]-N-methyl-2,3-dihydro-1,4-benzoxazine-2-carboxamide CAS Name: (2S)-4-[4-(3,4-dimethylphenyl)-1,4-dioxobutyl]-N-methyl-2,3-dihydro-1,4-benzoxazine-2-carboxamide IUPAC Name: (2S)-4-[4-(3,4-dimethylphenyl)-4-oxobutanoyl]-N-methyl-2,3-dihydro-1,4-benzoxazine-2-carboxamide Traditional Name: (2S)-4-[4-(3,4-dimethylphenyl)-4-keto-butanoyl]-N-methyl-2,3-dihydro-1,4-benzoxazine-2-carboxamide Formula: C22H24N2O4 MolecularWeight: 380.43696

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H24N2O4/c1-14-8-9-16(12-15(14)2)18(25)10-11-21(26)24-13-20(22(27)23-3)28-19-7-5-4-6-17(19)24/h4-9,12,20H,10-11,13H2,1-3H3,(H,23,27)/t20-/m0/s1