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

Systemtic Name: (2R)-2-methyl-4-[3-(4-methylphenoxy)propyl]-3-oxidanylidene-1,4-benzoxazine-6-carbaldehyde Openeye Name: (2R)-2-methyl-4-[3-(4-methylphenoxy)propyl]-3-oxo-1,4-benzoxazine-6-carbaldehyde CAS Name: (2R)-2-methyl-4-[3-(4-methylphenoxy)propyl]-3-oxo-1,4-benzoxazine-6-carboxaldehyde IUPAC Name: (2R)-2-methyl-4-[3-(4-methylphenoxy)propyl]-3-oxo-1,4-benzoxazine-6-carbaldehyde Traditional Name: (2R)-3-keto-2-methyl-4-[3-(4-methylphenoxy)propyl]-1,4-benzoxazine-6-carbaldehyde Formula: C20H21NO4 MolecularWeight: 339.38504

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(=O)N(C2=C(O1)C=CC(=C2)C=O)CCCOC3=CC=C(C=C3)C

Isomeric SMILES

C[C@@H]1C(=O)N(C2=C(O1)C=CC(=C2)C=O)CCCOC3=CC=C(C=C3)C

InChI

InChI=1S/C20H21NO4/c1-14-4-7-17(8-5-14)24-11-3-10-21-18-12-16(13-22)6-9-19(18)25-15(2)20(21)23/h4-9,12-13,15H,3,10-11H2,1-2H3/t15-/m1/s1