2-[[methyl(thiophen-3-ylmethyl)amino]methyl]-5-nitro-isoindole-1,3-dione

Systemtic Name: 2-[[methyl(thiophen-3-ylmethyl)amino]methyl]-5-nitro-isoindole-1,3-dione Openeye Name: 2-[[methyl(3-thienylmethyl)amino]methyl]-5-nitro-isoindoline-1,3-dione CAS Name: 2-[[methyl(3-thiophenylmethyl)amino]methyl]-5-nitroisoindole-1,3-dione IUPAC Name: 2-[[methyl(thiophen-3-ylmethyl)amino]methyl]-5-nitroisoindole-1,3-dione Traditional Name: 2-[[methyl(3-thenyl)amino]methyl]-5-nitro-isoindoline-1,3-quinone Formula: C15H13N3O4S MolecularWeight: 331.34642

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CSC=C1)CN2C(=O)C3=C(C2=O)C=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CN(CC1=CSC=C1)CN2C(=O)C3=C(C2=O)C=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C15H13N3O4S/c1-16(7-10-4-5-23-8-10)9-17-14(19)12-3-2-11(18(21)22)6-13(12)15(17)20/h2-6,8H,7,9H2,1H3