N-(3-nitro-4-piperazin-1-yl-phenyl)-3-propan-2-yloxy-benzamide

Systemtic Name: N-(3-nitro-4-piperazin-1-yl-phenyl)-3-propan-2-yloxy-benzamide Openeye Name: 3-isopropoxy-N-(3-nitro-4-piperazin-1-yl-phenyl)benzamide CAS Name: N-[3-nitro-4-(1-piperazinyl)phenyl]-3-propan-2-yloxybenzamide IUPAC Name: N-(3-nitro-4-piperazin-1-ylphenyl)-3-propan-2-yloxybenzamide Traditional Name: 3-isopropoxy-N-(3-nitro-4-piperazino-phenyl)benzamide Formula: C20H24N4O4 MolecularWeight: 384.42896

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=CC=CC(=C1)C(=O)NC2=CC(=C(C=C2)N3CCNCC3)[N+](=O)[O-]

Isomeric SMILES

CC(C)OC1=CC=CC(=C1)C(=O)NC2=CC(=C(C=C2)N3CCNCC3)[N+](=O)[O-]

InChI

InChI=1S/C20H24N4O4/c1-14(2)28-17-5-3-4-15(12-17)20(25)22-16-6-7-18(19(13-16)24(26)27)23-10-8-21-9-11-23/h3-7,12-14,21H,8-11H2,1-2H3,(H,22,25)