N-[8-(4-methylpiperazin-1-yl)naphthalen-2-yl]-3,5-dinitro-benzamide

Systemtic Name: N-[8-(4-methylpiperazin-1-yl)naphthalen-2-yl]-3,5-dinitro-benzamide Openeye Name: N-[8-(4-methylpiperazin-1-yl)-2-naphthyl]-3,5-dinitro-benzamide CAS Name: N-[8-(4-methyl-1-piperazinyl)-2-naphthalenyl]-3,5-dinitrobenzamide IUPAC Name: N-[8-(4-methylpiperazin-1-yl)naphthalen-2-yl]-3,5-dinitrobenzamide Traditional Name: N-[8-(4-methylpiperazino)-2-naphthyl]-3,5-dinitro-benzamide Formula: C22H21N5O5 MolecularWeight: 435.43264

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=CC=CC3=C2C=C(C=C3)NC(=O)C4=CC(=CC(=C4)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CN1CCN(CC1)C2=CC=CC3=C2C=C(C=C3)NC(=O)C4=CC(=CC(=C4)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C22H21N5O5/c1-24-7-9-25(10-8-24)21-4-2-3-15-5-6-17(13-20(15)21)23-22(28)16-11-18(26(29)30)14-19(12-16)27(31)32/h2-6,11-14H,7-10H2,1H3,(H,23,28)