5-(4-methylpiperazin-1-yl)-2-nitro-N-(oxolan-2-ylmethyl)aniline hydrochloride

Systemtic Name: 5-(4-methylpiperazin-1-yl)-2-nitro-N-(oxolan-2-ylmethyl)aniline hydrochloride Openeye Name: 5-(4-methylpiperazin-1-yl)-2-nitro-N-(tetrahydrofuran-2-ylmethyl)aniline hydrochloride CAS Name: 5-(4-methyl-1-piperazinyl)-2-nitro-N-(2-oxolanylmethyl)aniline hydrochloride IUPAC Name: 5-(4-methylpiperazin-1-yl)-2-nitro-N-(oxolan-2-ylmethyl)aniline hydrochloride Traditional Name: [5-(4-methylpiperazino)-2-nitro-phenyl]-(tetrahydrofurfuryl)amine hydrochloride Formula: C16H25ClN4O3 MolecularWeight: 356.8477

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=CC(=C(C=C2)[N+](=O)[O-])NCC3CCCO3.Cl

Isomeric SMILES

CN1CCN(CC1)C2=CC(=C(C=C2)[N+](=O)[O-])NCC3CCCO3.Cl

InChI

InChI=1S/C16H24N4O3.ClH/c1-18-6-8-19(9-7-18)13-4-5-16(20(21)22)15(11-13)17-12-14-3-2-10-23-14;/h4-5,11,14,17H,2-3,6-10,12H2,1H3;1H