2-azanyl-5-chloranyl-4-nitro-3-octan-3-yl-benzamide

Systemtic Name: 2-azanyl-5-chloranyl-4-nitro-3-octan-3-yl-benzamide Openeye Name: 2-amino-5-chloro-3-(1-ethylhexyl)-4-nitro-benzamide CAS Name: 2-amino-5-chloro-4-nitro-3-octan-3-ylbenzamide IUPAC Name: 2-amino-5-chloro-4-nitro-3-octan-3-ylbenzamide Traditional Name: 2-amino-5-chloro-3-(1-ethylhexyl)-4-nitro-benzamide Formula: C15H22ClN3O3 MolecularWeight: 327.80648

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H22ClN3O3/c1-3-5-6-7-9(4-2)12-13(17)10(15(18)20)8-11(16)14(12)19(21)22/h8-9H,3-7,17H2,1-2H3,(H2,18,20)