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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCC1C(=O)N(C2=C(O1)C=CC(=C2)C=O)CCOC3=CC=CC(=C3)C

Isomeric SMILES

CC[C@@H]1C(=O)N(C2=C(O1)C=CC(=C2)C=O)CCOC3=CC=CC(=C3)C

InChI

InChI=1S/C20H21NO4/c1-3-18-20(23)21(9-10-24-16-6-4-5-14(2)11-16)17-12-15(13-22)7-8-19(17)25-18/h4-8,11-13,18H,3,9-10H2,1-2H3/t18-/m1/s1