4-[1-(3-bromanyl-4-methoxy-phenyl)ethylamino]-3-nitro-benzamide

Systemtic Name: 4-[1-(3-bromanyl-4-methoxy-phenyl)ethylamino]-3-nitro-benzamide Openeye Name: 4-[1-(3-bromo-4-methoxy-phenyl)ethylamino]-3-nitro-benzamide CAS Name: 4-[1-(3-bromo-4-methoxyphenyl)ethylamino]-3-nitrobenzamide IUPAC Name: 4-[1-(3-bromo-4-methoxyphenyl)ethylamino]-3-nitrobenzamide Traditional Name: 4-[1-(3-bromo-4-methoxy-phenyl)ethylamino]-3-nitro-benzamide Formula: C16H16BrN3O4 MolecularWeight: 394.21994

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC(=C(C=C1)OC)Br)NC2=C(C=C(C=C2)C(=O)N)[N+](=O)[O-]

Isomeric SMILES

CC(C1=CC(=C(C=C1)OC)Br)NC2=C(C=C(C=C2)C(=O)N)[N+](=O)[O-]

InChI

InChI=1S/C16H16BrN3O4/c1-9(10-4-6-15(24-2)12(17)7-10)19-13-5-3-11(16(18)21)8-14(13)20(22)23/h3-9,19H,1-2H3,(H2,18,21)