7-(4-ethylpiperazin-1-yl)-4-nitro-N-(phenylmethyl)-2,1,3-benzoxadiazol-5-amine

Systemtic Name: 7-(4-ethylpiperazin-1-yl)-4-nitro-N-(phenylmethyl)-2,1,3-benzoxadiazol-5-amine Openeye Name: N-benzyl-7-(4-ethylpiperazin-1-yl)-4-nitro-2,1,3-benzoxadiazol-5-amine CAS Name: 7-(4-ethyl-1-piperazinyl)-4-nitro-N-(phenylmethyl)-2,1,3-benzoxadiazol-5-amine IUPAC Name: N-benzyl-7-(4-ethylpiperazin-1-yl)-4-nitro-2,1,3-benzoxadiazol-5-amine Traditional Name: benzyl-[7-(4-ethylpiperazino)-4-nitro-benzofurazan-5-yl]amine Formula: C19H22N6O3 MolecularWeight: 382.41638

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)C2=CC(=C(C3=NON=C23)[N+](=O)[O-])NCC4=CC=CC=C4

Isomeric SMILES

CCN1CCN(CC1)C2=CC(=C(C3=NON=C23)[N+](=O)[O-])NCC4=CC=CC=C4

InChI

InChI=1S/C19H22N6O3/c1-2-23-8-10-24(11-9-23)16-12-15(20-13-14-6-4-3-5-7-14)19(25(26)27)18-17(16)21-28-22-18/h3-7,12,20H,2,8-11,13H2,1H3