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

Systemtic Name: N-[2-[[4-(4-ethylpiperazin-1-yl)-3-methyl-phenyl]amino]-2-oxidanylidene-ethyl]-3-nitro-benzamide Openeye Name: N-[2-[4-(4-ethylpiperazin-1-yl)-3-methyl-anilino]-2-oxo-ethyl]-3-nitro-benzamide CAS Name: N-[2-[4-(4-ethyl-1-piperazinyl)-3-methylanilino]-2-oxoethyl]-3-nitrobenzamide IUPAC Name: N-[2-[4-(4-ethylpiperazin-1-yl)-3-methylanilino]-2-oxoethyl]-3-nitrobenzamide Traditional Name: N-[2-[4-(4-ethylpiperazino)-3-methyl-anilino]-2-keto-ethyl]-3-nitro-benzamide Formula: C22H27N5O4 MolecularWeight: 425.48088

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H27N5O4/c1-3-25-9-11-26(12-10-25)20-8-7-18(13-16(20)2)24-21(28)15-23-22(29)17-5-4-6-19(14-17)27(30)31/h4-8,13-14H,3,9-12,15H2,1-2H3,(H,23,29)(H,24,28)