3-(4-chloranyl-3-nitro-phenyl)-N-(4,6-dimethoxy-1,3-benzothiazol-2-yl)prop-2-enamide

Systemtic Name: 3-(4-chloranyl-3-nitro-phenyl)-N-(4,6-dimethoxy-1,3-benzothiazol-2-yl)prop-2-enamide Openeye Name: 3-(4-chloro-3-nitro-phenyl)-N-(4,6-dimethoxy-1,3-benzothiazol-2-yl)prop-2-enamide CAS Name: 3-(4-chloro-3-nitrophenyl)-N-(4,6-dimethoxy-1,3-benzothiazol-2-yl)-2-propenamide IUPAC Name: 3-(4-chloro-3-nitrophenyl)-N-(4,6-dimethoxy-1,3-benzothiazol-2-yl)prop-2-enamide Traditional Name: 3-(4-chloro-3-nitro-phenyl)-N-(4,6-dimethoxy-1,3-benzothiazol-2-yl)acrylamide Formula: C18H14ClN3O5S MolecularWeight: 419.83886

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C2C(=C1)SC(=N2)NC(=O)C=CC3=CC(=C(C=C3)Cl)[N+](=O)[O-])OC

Isomeric SMILES

COC1=CC(=C2C(=C1)SC(=N2)NC(=O)C=CC3=CC(=C(C=C3)Cl)[N+](=O)[O-])OC

InChI

InChI=1S/C18H14ClN3O5S/c1-26-11-8-14(27-2)17-15(9-11)28-18(21-17)20-16(23)6-4-10-3-5-12(19)13(7-10)22(24)25/h3-9H,1-2H3,(H,20,21,23)