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

Systemtic Name: N-[[2-(diethylaminomethyl)phenyl]methyl]-3-[(2S)-2-methyl-3-oxidanylidene-1,4-benzoxazin-4-yl]propanamide Openeye Name: N-[[2-(diethylaminomethyl)phenyl]methyl]-3-[(2S)-2-methyl-3-oxo-1,4-benzoxazin-4-yl]propanamide CAS Name: N-[[2-(diethylaminomethyl)phenyl]methyl]-3-[(2S)-2-methyl-3-oxo-1,4-benzoxazin-4-yl]propanamide IUPAC Name: N-[[2-(diethylaminomethyl)phenyl]methyl]-3-[(2S)-2-methyl-3-oxo-1,4-benzoxazin-4-yl]propanamide Traditional Name: N-[2-(diethylaminomethyl)benzyl]-3-[(2S)-3-keto-2-methyl-1,4-benzoxazin-4-yl]propionamide Formula: C24H31N3O3 MolecularWeight: 409.52124

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CC1=CC=CC=C1CNC(=O)CCN2C3=CC=CC=C3OC(C2=O)C

Isomeric SMILES

CCN(CC)CC1=CC=CC=C1CNC(=O)CCN2C3=CC=CC=C3O[C@H](C2=O)C

InChI

InChI=1S/C24H31N3O3/c1-4-26(5-2)17-20-11-7-6-10-19(20)16-25-23(28)14-15-27-21-12-8-9-13-22(21)30-18(3)24(27)29/h6-13,18H,4-5,14-17H2,1-3H3,(H,25,28)/t18-/m0/s1