4-butyl-N-(6-nitro-2-oxidanylidene-chromen-3-yl)benzamide

Systemtic Name: 4-butyl-N-(6-nitro-2-oxidanylidene-chromen-3-yl)benzamide Openeye Name: 4-butyl-N-(6-nitro-2-oxo-chromen-3-yl)benzamide CAS Name: 4-butyl-N-(6-nitro-2-oxo-1-benzopyran-3-yl)benzamide IUPAC Name: 4-butyl-N-(6-nitro-2-oxochromen-3-yl)benzamide Traditional Name: 4-butyl-N-(2-keto-6-nitro-chromen-3-yl)benzamide Formula: C20H18N2O5 MolecularWeight: 366.36732

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)C(=O)NC2=CC3=C(C=CC(=C3)[N+](=O)[O-])OC2=O

Isomeric SMILES

CCCCC1=CC=C(C=C1)C(=O)NC2=CC3=C(C=CC(=C3)[N+](=O)[O-])OC2=O

InChI

InChI=1S/C20H18N2O5/c1-2-3-4-13-5-7-14(8-6-13)19(23)21-17-12-15-11-16(22(25)26)9-10-18(15)27-20(17)24/h5-12H,2-4H2,1H3,(H,21,23)