N-(2,6-diethylphenyl)-3-[(2S)-2-methyl-3-oxidanylidene-1,4-benzoxazin-4-yl]propanamide

Systemtic Name: N-(2,6-diethylphenyl)-3-[(2S)-2-methyl-3-oxidanylidene-1,4-benzoxazin-4-yl]propanamide Openeye Name: N-(2,6-diethylphenyl)-3-[(2S)-2-methyl-3-oxo-1,4-benzoxazin-4-yl]propanamide CAS Name: N-(2,6-diethylphenyl)-3-[(2S)-2-methyl-3-oxo-1,4-benzoxazin-4-yl]propanamide IUPAC Name: N-(2,6-diethylphenyl)-3-[(2S)-2-methyl-3-oxo-1,4-benzoxazin-4-yl]propanamide Traditional Name: N-(2,6-diethylphenyl)-3-[(2S)-3-keto-2-methyl-1,4-benzoxazin-4-yl]propionamide Formula: C22H26N2O3 MolecularWeight: 366.45344

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=CC=C1)CC)NC(=O)CCN2C3=CC=CC=C3OC(C2=O)C

Isomeric SMILES

CCC1=C(C(=CC=C1)CC)NC(=O)CCN2C3=CC=CC=C3O[C@H](C2=O)C

InChI

InChI=1S/C22H26N2O3/c1-4-16-9-8-10-17(5-2)21(16)23-20(25)13-14-24-18-11-6-7-12-19(18)27-15(3)22(24)26/h6-12,15H,4-5,13-14H2,1-3H3,(H,23,25)/t15-/m0/s1