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

Systemtic Name: (2S)-4-[3-(4-methoxyphenoxy)propyl]-2-methyl-3-oxidanylidene-1,4-benzoxazine-6-carbaldehyde Openeye Name: (2S)-4-[3-(4-methoxyphenoxy)propyl]-2-methyl-3-oxo-1,4-benzoxazine-6-carbaldehyde CAS Name: (2S)-4-[3-(4-methoxyphenoxy)propyl]-2-methyl-3-oxo-1,4-benzoxazine-6-carboxaldehyde IUPAC Name: (2S)-4-[3-(4-methoxyphenoxy)propyl]-2-methyl-3-oxo-1,4-benzoxazine-6-carbaldehyde Traditional Name: (2S)-3-keto-4-[3-(4-methoxyphenoxy)propyl]-2-methyl-1,4-benzoxazine-6-carbaldehyde Formula: C20H21NO5 MolecularWeight: 355.38444

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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)OC

Isomeric SMILES

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

InChI

InChI=1S/C20H21NO5/c1-14-20(23)21(18-12-15(13-22)4-9-19(18)26-14)10-3-11-25-17-7-5-16(24-2)6-8-17/h4-9,12-14H,3,10-11H2,1-2H3/t14-/m0/s1