methyl (E)-3-[1-[(2,4-dichlorophenyl)methyl]-6-nitro-indazol-3-yl]prop-2-enoate

Systemtic Name: methyl (E)-3-[1-[(2,4-dichlorophenyl)methyl]-6-nitro-indazol-3-yl]prop-2-enoate Openeye Name: methyl (E)-3-[1-[(2,4-dichlorophenyl)methyl]-6-nitro-indazol-3-yl]prop-2-enoate CAS Name: (E)-3-[1-[(2,4-dichlorophenyl)methyl]-6-nitro-3-indazolyl]-2-propenoic acid methyl ester IUPAC Name: methyl (E)-3-[1-[(2,4-dichlorophenyl)methyl]-6-nitroindazol-3-yl]prop-2-enoate Traditional Name: (E)-3-[1-(2,4-dichlorobenzyl)-6-nitro-indazol-3-yl]acrylic acid methyl ester Formula: C18H13Cl2N3O4 MolecularWeight: 406.21952

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C=CC1=NN(C2=C1C=CC(=C2)[N+](=O)[O-])CC3=C(C=C(C=C3)Cl)Cl

Isomeric SMILES

COC(=O)/C=C/C1=NN(C2=C1C=CC(=C2)[N+](=O)[O-])CC3=C(C=C(C=C3)Cl)Cl

InChI

InChI=1S/C18H13Cl2N3O4/c1-27-18(24)7-6-16-14-5-4-13(23(25)26)9-17(14)22(21-16)10-11-2-3-12(19)8-15(11)20/h2-9H,10H2,1H3/b7-6+