4-azanyl-N-[4-(4-ethylpiperazin-1-yl)-2-methyl-phenyl]-3-nitro-benzamide

Systemtic Name: 4-azanyl-N-[4-(4-ethylpiperazin-1-yl)-2-methyl-phenyl]-3-nitro-benzamide Openeye Name: 4-amino-N-[4-(4-ethylpiperazin-1-yl)-2-methyl-phenyl]-3-nitro-benzamide CAS Name: 4-amino-N-[4-(4-ethyl-1-piperazinyl)-2-methylphenyl]-3-nitrobenzamide IUPAC Name: 4-amino-N-[4-(4-ethylpiperazin-1-yl)-2-methylphenyl]-3-nitrobenzamide Traditional Name: 4-amino-N-[4-(4-ethylpiperazino)-2-methyl-phenyl]-3-nitro-benzamide Formula: C20H25N5O3 MolecularWeight: 383.4442

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)C2=CC(=C(C=C2)NC(=O)C3=CC(=C(C=C3)N)[N+](=O)[O-])C

Isomeric SMILES

CCN1CCN(CC1)C2=CC(=C(C=C2)NC(=O)C3=CC(=C(C=C3)N)[N+](=O)[O-])C

InChI

InChI=1S/C20H25N5O3/c1-3-23-8-10-24(11-9-23)16-5-7-18(14(2)12-16)22-20(26)15-4-6-17(21)19(13-15)25(27)28/h4-7,12-13H,3,8-11,21H2,1-2H3,(H,22,26)