N-[(5-bromanylthiophen-2-yl)methyl]-4-methoxy-3-nitro-N-prop-2-enyl-benzamide

Systemtic Name: N-[(5-bromanylthiophen-2-yl)methyl]-4-methoxy-3-nitro-N-prop-2-enyl-benzamide Openeye Name: N-allyl-N-[(5-bromo-2-thienyl)methyl]-4-methoxy-3-nitro-benzamide CAS Name: N-[(5-bromo-2-thiophenyl)methyl]-4-methoxy-3-nitro-N-prop-2-enylbenzamide IUPAC Name: N-[(5-bromothiophen-2-yl)methyl]-4-methoxy-3-nitro-N-prop-2-enylbenzamide Traditional Name: N-allyl-N-[(5-bromo-2-thienyl)methyl]-4-methoxy-3-nitro-benzamide Formula: C16H15BrN2O4S MolecularWeight: 411.2703

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)N(CC=C)CC2=CC=C(S2)Br)[N+](=O)[O-]

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)N(CC=C)CC2=CC=C(S2)Br)[N+](=O)[O-]

InChI

InChI=1S/C16H15BrN2O4S/c1-3-8-18(10-12-5-7-15(17)24-12)16(20)11-4-6-14(23-2)13(9-11)19(21)22/h3-7,9H,1,8,10H2,2H3