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

Systemtic Name: N-[(2S)-butan-2-yl]-3-[(6-methyl-3-oxidanylidene-1,4-benzoxazin-4-yl)methyl]benzamide Openeye Name: 3-[(6-methyl-3-oxo-1,4-benzoxazin-4-yl)methyl]-N-[(1S)-1-methylpropyl]benzamide CAS Name: N-[(2S)-butan-2-yl]-3-[(6-methyl-3-oxo-1,4-benzoxazin-4-yl)methyl]benzamide IUPAC Name: N-[(2S)-butan-2-yl]-3-[(6-methyl-3-oxo-1,4-benzoxazin-4-yl)methyl]benzamide Traditional Name: 3-[(3-keto-6-methyl-1,4-benzoxazin-4-yl)methyl]-N-[(1S)-1-methylpropyl]benzamide Formula: C21H24N2O3 MolecularWeight: 352.42686

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC(=O)C1=CC(=CC=C1)CN2C(=O)COC3=C2C=C(C=C3)C

Isomeric SMILES

CC[C@H](C)NC(=O)C1=CC(=CC=C1)CN2C(=O)COC3=C2C=C(C=C3)C

InChI

InChI=1S/C21H24N2O3/c1-4-15(3)22-21(25)17-7-5-6-16(11-17)12-23-18-10-14(2)8-9-19(18)26-13-20(23)24/h5-11,15H,4,12-13H2,1-3H3,(H,22,25)/t15-/m0/s1