2-[[cyclopropyl(thiophen-2-ylmethyl)amino]methyl]-4-nitro-isoindole-1,3-dione

Systemtic Name: 2-[[cyclopropyl(thiophen-2-ylmethyl)amino]methyl]-4-nitro-isoindole-1,3-dione Openeye Name: 2-[[cyclopropyl(2-thienylmethyl)amino]methyl]-4-nitro-isoindoline-1,3-dione CAS Name: 2-[[cyclopropyl(thiophen-2-ylmethyl)amino]methyl]-4-nitroisoindole-1,3-dione IUPAC Name: 2-[[cyclopropyl(thiophen-2-ylmethyl)amino]methyl]-4-nitroisoindole-1,3-dione Traditional Name: 2-[[cyclopropyl(2-thenyl)amino]methyl]-4-nitro-isoindoline-1,3-quinone Formula: C17H15N3O4S MolecularWeight: 357.3837

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1N(CC2=CC=CS2)CN3C(=O)C4=C(C3=O)C(=CC=C4)[N+](=O)[O-]

Isomeric SMILES

C1CC1N(CC2=CC=CS2)CN3C(=O)C4=C(C3=O)C(=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C17H15N3O4S/c21-16-13-4-1-5-14(20(23)24)15(13)17(22)19(16)10-18(11-6-7-11)9-12-3-2-8-25-12/h1-5,8,11H,6-7,9-10H2