3-nitro-4-(1-oxidanylbutan-2-ylamino)benzamide

Systemtic Name: 3-nitro-4-(1-oxidanylbutan-2-ylamino)benzamide Openeye Name: 4-[1-(hydroxymethyl)propylamino]-3-nitro-benzamide CAS Name: 4-(1-hydroxybutan-2-ylamino)-3-nitrobenzamide IUPAC Name: 4-(1-hydroxybutan-2-ylamino)-3-nitrobenzamide Traditional Name: 4-(1-methylolpropylamino)-3-nitro-benzamide Formula: C11H15N3O4 MolecularWeight: 253.2545

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CO)NC1=C(C=C(C=C1)C(=O)N)[N+](=O)[O-]

Isomeric SMILES

CCC(CO)NC1=C(C=C(C=C1)C(=O)N)[N+](=O)[O-]

InChI

InChI=1S/C11H15N3O4/c1-2-8(6-15)13-9-4-3-7(11(12)16)5-10(9)14(17)18/h3-5,8,13,15H,2,6H2,1H3,(H2,12,16)