2-(3,4-dipropoxyphenyl)carbonyl-N-(3-oxidanylidene-4H-1,4-benzoxazin-6-yl)benzamide

Systemtic Name: 2-(3,4-dipropoxyphenyl)carbonyl-N-(3-oxidanylidene-4H-1,4-benzoxazin-6-yl)benzamide Openeye Name: 2-(3,4-dipropoxybenzoyl)-N-(3-oxo-4H-1,4-benzoxazin-6-yl)benzamide CAS Name: 2-[(3,4-dipropoxyphenyl)-oxomethyl]-N-(3-oxo-4H-1,4-benzoxazin-6-yl)benzamide IUPAC Name: 2-(3,4-dipropoxybenzoyl)-N-(3-oxo-4H-1,4-benzoxazin-6-yl)benzamide Traditional Name: 2-(3,4-dipropoxybenzoyl)-N-(3-keto-4H-1,4-benzoxazin-6-yl)benzamide Formula: C28H28N2O6 MolecularWeight: 488.53172

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1)C(=O)C2=CC=CC=C2C(=O)NC3=CC4=C(C=C3)OCC(=O)N4)OCCC

Isomeric SMILES

CCCOC1=C(C=C(C=C1)C(=O)C2=CC=CC=C2C(=O)NC3=CC4=C(C=C3)OCC(=O)N4)OCCC

InChI

InChI=1S/C28H28N2O6/c1-3-13-34-24-11-9-18(15-25(24)35-14-4-2)27(32)20-7-5-6-8-21(20)28(33)29-19-10-12-23-22(16-19)30-26(31)17-36-23/h5-12,15-16H,3-4,13-14,17H2,1-2H3,(H,29,33)(H,30,31)