N-[1-(3,4-dipropoxyphenyl)ethyl]-2-(6-nitro-3-oxidanylidene-1,4-benzoxazin-4-yl)ethanamide

Systemtic Name: N-[1-(3,4-dipropoxyphenyl)ethyl]-2-(6-nitro-3-oxidanylidene-1,4-benzoxazin-4-yl)ethanamide Openeye Name: N-[1-(3,4-dipropoxyphenyl)ethyl]-2-(6-nitro-3-oxo-1,4-benzoxazin-4-yl)acetamide CAS Name: N-[1-(3,4-dipropoxyphenyl)ethyl]-2-(6-nitro-3-oxo-1,4-benzoxazin-4-yl)acetamide IUPAC Name: N-[1-(3,4-dipropoxyphenyl)ethyl]-2-(6-nitro-3-oxo-1,4-benzoxazin-4-yl)acetamide Traditional Name: N-[1-(3,4-dipropoxyphenyl)ethyl]-2-(3-keto-6-nitro-1,4-benzoxazin-4-yl)acetamide Formula: C24H29N3O7 MolecularWeight: 471.50296

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1)C(C)NC(=O)CN2C(=O)COC3=C2C=C(C=C3)[N+](=O)[O-])OCCC

Isomeric SMILES

CCCOC1=C(C=C(C=C1)C(C)NC(=O)CN2C(=O)COC3=C2C=C(C=C3)[N+](=O)[O-])OCCC

InChI

InChI=1S/C24H29N3O7/c1-4-10-32-21-8-6-17(12-22(21)33-11-5-2)16(3)25-23(28)14-26-19-13-18(27(30)31)7-9-20(19)34-15-24(26)29/h6-9,12-13,16H,4-5,10-11,14-15H2,1-3H3,(H,25,28)