4-(3-methylbutylamino)-3-nitro-benzamide

Systemtic Name: 4-(3-methylbutylamino)-3-nitro-benzamide Openeye Name: 4-(isopentylamino)-3-nitro-benzamide CAS Name: 4-(3-methylbutylamino)-3-nitrobenzamide IUPAC Name: 4-(3-methylbutylamino)-3-nitrobenzamide Traditional Name: 4-(isoamylamino)-3-nitro-benzamide Formula: C12H17N3O3 MolecularWeight: 251.28168

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCNC1=C(C=C(C=C1)C(=O)N)[N+](=O)[O-]

Isomeric SMILES

CC(C)CCNC1=C(C=C(C=C1)C(=O)N)[N+](=O)[O-]

InChI

InChI=1S/C12H17N3O3/c1-8(2)5-6-14-10-4-3-9(12(13)16)7-11(10)15(17)18/h3-4,7-8,14H,5-6H2,1-2H3,(H2,13,16)