5-bromanyl-2-methoxy-3-methyl-N-(3-nitro-4-piperazin-1-yl-phenyl)benzamide

Systemtic Name: 5-bromanyl-2-methoxy-3-methyl-N-(3-nitro-4-piperazin-1-yl-phenyl)benzamide Openeye Name: 5-bromo-2-methoxy-3-methyl-N-(3-nitro-4-piperazin-1-yl-phenyl)benzamide CAS Name: 5-bromo-2-methoxy-3-methyl-N-[3-nitro-4-(1-piperazinyl)phenyl]benzamide IUPAC Name: 5-bromo-2-methoxy-3-methyl-N-(3-nitro-4-piperazin-1-ylphenyl)benzamide Traditional Name: 5-bromo-2-methoxy-3-methyl-N-(3-nitro-4-piperazino-phenyl)benzamide Formula: C19H21BrN4O4 MolecularWeight: 449.29844

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC(=C1)Br)C(=O)NC2=CC(=C(C=C2)N3CCNCC3)[N+](=O)[O-])OC

Isomeric SMILES

CC1=C(C(=CC(=C1)Br)C(=O)NC2=CC(=C(C=C2)N3CCNCC3)[N+](=O)[O-])OC

InChI

InChI=1S/C19H21BrN4O4/c1-12-9-13(20)10-15(18(12)28-2)19(25)22-14-3-4-16(17(11-14)24(26)27)23-7-5-21-6-8-23/h3-4,9-11,21H,5-8H2,1-2H3,(H,22,25)