N-(2-methoxyethyl)-2-nitro-5-piperazin-1-yl-aniline hydrochloride

Systemtic Name: N-(2-methoxyethyl)-2-nitro-5-piperazin-1-yl-aniline hydrochloride Openeye Name: N-(2-methoxyethyl)-2-nitro-5-piperazin-1-yl-aniline hydrochloride CAS Name: N-(2-methoxyethyl)-2-nitro-5-(1-piperazinyl)aniline hydrochloride IUPAC Name: N-(2-methoxyethyl)-2-nitro-5-piperazin-1-ylaniline hydrochloride Traditional Name: 2-methoxyethyl-(2-nitro-5-piperazino-phenyl)amine hydrochloride Formula: C13H21ClN4O3 MolecularWeight: 316.78384

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Descriptors Computed from Structure

Canonical SMILES:

COCCNC1=C(C=CC(=C1)N2CCNCC2)[N+](=O)[O-].Cl

Isomeric SMILES

COCCNC1=C(C=CC(=C1)N2CCNCC2)[N+](=O)[O-].Cl

InChI

InChI=1S/C13H20N4O3.ClH/c1-20-9-6-15-12-10-11(2-3-13(12)17(18)19)16-7-4-14-5-8-16;/h2-3,10,14-15H,4-9H2,1H3;1H