N-[(5-bromanylthiophen-3-yl)methyl]-2-methoxy-4-nitro-aniline

Systemtic Name: N-[(5-bromanylthiophen-3-yl)methyl]-2-methoxy-4-nitro-aniline Openeye Name: N-[(5-bromo-3-thienyl)methyl]-2-methoxy-4-nitro-aniline CAS Name: N-[(5-bromo-3-thiophenyl)methyl]-2-methoxy-4-nitroaniline IUPAC Name: N-[(5-bromothiophen-3-yl)methyl]-2-methoxy-4-nitroaniline Traditional Name: (5-bromo-3-thienyl)methyl-(2-methoxy-4-nitro-phenyl)amine Formula: C12H11BrN2O3S MolecularWeight: 343.19634

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)[N+](=O)[O-])NCC2=CSC(=C2)Br

Isomeric SMILES

COC1=C(C=CC(=C1)[N+](=O)[O-])NCC2=CSC(=C2)Br

InChI

InChI=1S/C12H11BrN2O3S/c1-18-11-5-9(15(16)17)2-3-10(11)14-6-8-4-12(13)19-7-8/h2-5,7,14H,6H2,1H3