3-nitro-4-[[oxolan-2-ylmethyl(thiophen-2-ylmethyl)amino]methyl]benzamide

Systemtic Name: 3-nitro-4-[[oxolan-2-ylmethyl(thiophen-2-ylmethyl)amino]methyl]benzamide Openeye Name: 3-nitro-4-[[tetrahydrofuran-2-ylmethyl(2-thienylmethyl)amino]methyl]benzamide CAS Name: 3-nitro-4-[[2-oxolanylmethyl(thiophen-2-ylmethyl)amino]methyl]benzamide IUPAC Name: 3-nitro-4-[[oxolan-2-ylmethyl(thiophen-2-ylmethyl)amino]methyl]benzamide Traditional Name: 3-nitro-4-[[tetrahydrofurfuryl(2-thenyl)amino]methyl]benzamide Formula: C18H21N3O4S MolecularWeight: 375.44204

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC1)CN(CC2=C(C=C(C=C2)C(=O)N)[N+](=O)[O-])CC3=CC=CS3

Isomeric SMILES

C1CC(OC1)CN(CC2=C(C=C(C=C2)C(=O)N)[N+](=O)[O-])CC3=CC=CS3

InChI

InChI=1S/C18H21N3O4S/c19-18(22)13-5-6-14(17(9-13)21(23)24)10-20(11-15-3-1-7-25-15)12-16-4-2-8-26-16/h2,4-6,8-9,15H,1,3,7,10-12H2,(H2,19,22)