(2R)-2-methyl-3-oxidanylidene-4-(4-phenoxybutyl)-1,4-benzoxazine-6-carbaldehyde

Systemtic Name: (2R)-2-methyl-3-oxidanylidene-4-(4-phenoxybutyl)-1,4-benzoxazine-6-carbaldehyde Openeye Name: (2R)-2-methyl-3-oxo-4-(4-phenoxybutyl)-1,4-benzoxazine-6-carbaldehyde CAS Name: (2R)-2-methyl-3-oxo-4-(4-phenoxybutyl)-1,4-benzoxazine-6-carboxaldehyde IUPAC Name: (2R)-2-methyl-3-oxo-4-(4-phenoxybutyl)-1,4-benzoxazine-6-carbaldehyde Traditional Name: (2R)-3-keto-2-methyl-4-(4-phenoxybutyl)-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)CCCCOC3=CC=CC=C3

Isomeric SMILES

C[C@@H]1C(=O)N(C2=C(O1)C=CC(=C2)C=O)CCCCOC3=CC=CC=C3

InChI

InChI=1S/C20H21NO4/c1-15-20(23)21(18-13-16(14-22)9-10-19(18)25-15)11-5-6-12-24-17-7-3-2-4-8-17/h2-4,7-10,13-15H,5-6,11-12H2,1H3/t15-/m1/s1