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

Systemtic Name: (2R)-4-[3-(4-chloranylphenoxy)propyl]-2-methyl-3-oxidanylidene-1,4-benzoxazine-6-carbaldehyde Openeye Name: (2R)-4-[3-(4-chlorophenoxy)propyl]-2-methyl-3-oxo-1,4-benzoxazine-6-carbaldehyde CAS Name: (2R)-4-[3-(4-chlorophenoxy)propyl]-2-methyl-3-oxo-1,4-benzoxazine-6-carboxaldehyde IUPAC Name: (2R)-4-[3-(4-chlorophenoxy)propyl]-2-methyl-3-oxo-1,4-benzoxazine-6-carbaldehyde Traditional Name: (2R)-4-[3-(4-chlorophenoxy)propyl]-3-keto-2-methyl-1,4-benzoxazine-6-carbaldehyde Formula: C19H18ClNO4 MolecularWeight: 359.80352

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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)Cl

Isomeric SMILES

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

InChI

InChI=1S/C19H18ClNO4/c1-13-19(23)21(17-11-14(12-22)3-8-18(17)25-13)9-2-10-24-16-6-4-15(20)5-7-16/h3-8,11-13H,2,9-10H2,1H3/t13-/m1/s1