N-[4-[[(E)-3-(4-chloranyl-3-nitro-phenyl)prop-2-enoyl]amino]-2-methoxy-phenyl]thiophene-2-carboxamide

Systemtic Name: N-[4-[[(E)-3-(4-chloranyl-3-nitro-phenyl)prop-2-enoyl]amino]-2-methoxy-phenyl]thiophene-2-carboxamide Openeye Name: N-[4-[[(E)-3-(4-chloro-3-nitro-phenyl)prop-2-enoyl]amino]-2-methoxy-phenyl]thiophene-2-carboxamide CAS Name: N-[4-[[(E)-3-(4-chloro-3-nitrophenyl)-1-oxoprop-2-enyl]amino]-2-methoxyphenyl]-2-thiophenecarboxamide IUPAC Name: N-[4-[[(E)-3-(4-chloro-3-nitrophenyl)prop-2-enoyl]amino]-2-methoxyphenyl]thiophene-2-carboxamide Traditional Name: N-[4-[[(E)-3-(4-chloro-3-nitro-phenyl)acryloyl]amino]-2-methoxy-phenyl]thiophene-2-carboxamide Formula: C21H16ClN3O5S MolecularWeight: 457.88684

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)NC(=O)C=CC2=CC(=C(C=C2)Cl)[N+](=O)[O-])NC(=O)C3=CC=CS3

Isomeric SMILES

COC1=C(C=CC(=C1)NC(=O)/C=C/C2=CC(=C(C=C2)Cl)[N+](=O)[O-])NC(=O)C3=CC=CS3

InChI

InChI=1S/C21H16ClN3O5S/c1-30-18-12-14(6-8-16(18)24-21(27)19-3-2-10-31-19)23-20(26)9-5-13-4-7-15(22)17(11-13)25(28)29/h2-12H,1H3,(H,23,26)(H,24,27)/b9-5+