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

Systemtic Name: (2S)-4-[4-(4-ethoxyphenyl)-4-oxidanylidene-butanoyl]-N-methyl-2,3-dihydro-1,4-benzoxazine-2-carboxamide Openeye Name: (2S)-4-[4-(4-ethoxyphenyl)-4-oxo-butanoyl]-N-methyl-2,3-dihydro-1,4-benzoxazine-2-carboxamide CAS Name: (2S)-4-[4-(4-ethoxyphenyl)-1,4-dioxobutyl]-N-methyl-2,3-dihydro-1,4-benzoxazine-2-carboxamide IUPAC Name: (2S)-4-[4-(4-ethoxyphenyl)-4-oxobutanoyl]-N-methyl-2,3-dihydro-1,4-benzoxazine-2-carboxamide Traditional Name: (2S)-4-(4-keto-4-p-phenetyl-butanoyl)-N-methyl-2,3-dihydro-1,4-benzoxazine-2-carboxamide Formula: C22H24N2O5 MolecularWeight: 396.43636

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C(=O)CCC(=O)N2CC(OC3=CC=CC=C32)C(=O)NC

Isomeric SMILES

CCOC1=CC=C(C=C1)C(=O)CCC(=O)N2C[C@H](OC3=CC=CC=C32)C(=O)NC

InChI

InChI=1S/C22H24N2O5/c1-3-28-16-10-8-15(9-11-16)18(25)12-13-21(26)24-14-20(22(27)23-2)29-19-7-5-4-6-17(19)24/h4-11,20H,3,12-14H2,1-2H3,(H,23,27)/t20-/m0/s1