3-oxidanylidene-4-(3-phenoxypropyl)-1,4-benzoxazine-6-carbaldehyde

Systemtic Name: 3-oxidanylidene-4-(3-phenoxypropyl)-1,4-benzoxazine-6-carbaldehyde Openeye Name: 3-oxo-4-(3-phenoxypropyl)-1,4-benzoxazine-6-carbaldehyde CAS Name: 3-oxo-4-(3-phenoxypropyl)-1,4-benzoxazine-6-carboxaldehyde IUPAC Name: 3-oxo-4-(3-phenoxypropyl)-1,4-benzoxazine-6-carbaldehyde Traditional Name: 3-keto-4-(3-phenoxypropyl)-1,4-benzoxazine-6-carbaldehyde Formula: C18H17NO4 MolecularWeight: 311.33188

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=O)N(C2=C(O1)C=CC(=C2)C=O)CCCOC3=CC=CC=C3

Isomeric SMILES

C1C(=O)N(C2=C(O1)C=CC(=C2)C=O)CCCOC3=CC=CC=C3

InChI

InChI=1S/C18H17NO4/c20-12-14-7-8-17-16(11-14)19(18(21)13-23-17)9-4-10-22-15-5-2-1-3-6-15/h1-3,5-8,11-12H,4,9-10,13H2