(2R)-2-ethyl-4-[(4-methylphenyl)methyl]-3-oxidanylidene-1,4-benzoxazine-6-carbaldehyde

Systemtic Name: (2R)-2-ethyl-4-[(4-methylphenyl)methyl]-3-oxidanylidene-1,4-benzoxazine-6-carbaldehyde Openeye Name: (2R)-2-ethyl-3-oxo-4-(p-tolylmethyl)-1,4-benzoxazine-6-carbaldehyde CAS Name: (2R)-2-ethyl-4-[(4-methylphenyl)methyl]-3-oxo-1,4-benzoxazine-6-carboxaldehyde IUPAC Name: (2R)-2-ethyl-4-[(4-methylphenyl)methyl]-3-oxo-1,4-benzoxazine-6-carbaldehyde Traditional Name: (2R)-2-ethyl-3-keto-4-(4-methylbenzyl)-1,4-benzoxazine-6-carbaldehyde Formula: C19H19NO3 MolecularWeight: 309.35906

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1C(=O)N(C2=C(O1)C=CC(=C2)C=O)CC3=CC=C(C=C3)C

Isomeric SMILES

CC[C@@H]1C(=O)N(C2=C(O1)C=CC(=C2)C=O)CC3=CC=C(C=C3)C

InChI

InChI=1S/C19H19NO3/c1-3-17-19(22)20(11-14-6-4-13(2)5-7-14)16-10-15(12-21)8-9-18(16)23-17/h4-10,12,17H,3,11H2,1-2H3/t17-/m1/s1