[4-[[methyl(propan-2-yl)amino]methyl]piperidin-1-yl]-(5-nitro-1-benzothiophen-2-yl)methanone

Systemtic Name: [4-[[methyl(propan-2-yl)amino]methyl]piperidin-1-yl]-(5-nitro-1-benzothiophen-2-yl)methanone Openeye Name: [4-[[isopropyl(methyl)amino]methyl]-1-piperidyl]-(5-nitrobenzothiophen-2-yl)methanone CAS Name: [4-[[methyl(propan-2-yl)amino]methyl]-1-piperidinyl]-(5-nitro-1-benzothiophen-2-yl)methanone IUPAC Name: [4-[[methyl(propan-2-yl)amino]methyl]piperidin-1-yl]-(5-nitro-1-benzothiophen-2-yl)methanone Traditional Name: [4-[[isopropyl(methyl)amino]methyl]piperidino]-(5-nitrobenzothiophen-2-yl)methanone Formula: C19H25N3O3S MolecularWeight: 375.4851

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N(C)CC1CCN(CC1)C(=O)C2=CC3=C(S2)C=CC(=C3)[N+](=O)[O-]

Isomeric SMILES

CC(C)N(C)CC1CCN(CC1)C(=O)C2=CC3=C(S2)C=CC(=C3)[N+](=O)[O-]

InChI

InChI=1S/C19H25N3O3S/c1-13(2)20(3)12-14-6-8-21(9-7-14)19(23)18-11-15-10-16(22(24)25)4-5-17(15)26-18/h4-5,10-11,13-14H,6-9,12H2,1-3H3