methyl (E)-4-(2-methyl-6-nitro-1H-indol-3-yl)but-2-enoate

Systemtic Name: methyl (E)-4-(2-methyl-6-nitro-1H-indol-3-yl)but-2-enoate Openeye Name: methyl (E)-4-(2-methyl-6-nitro-1H-indol-3-yl)but-2-enoate CAS Name: (E)-4-(2-methyl-6-nitro-1H-indol-3-yl)-2-butenoic acid methyl ester IUPAC Name: methyl (E)-4-(2-methyl-6-nitro-1H-indol-3-yl)but-2-enoate Traditional Name: (E)-4-(2-methyl-6-nitro-1H-indol-3-yl)but-2-enoic acid methyl ester Formula: C14H14N2O4 MolecularWeight: 274.27196

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(N1)C=C(C=C2)[N+](=O)[O-])CC=CC(=O)OC

Isomeric SMILES

CC1=C(C2=C(N1)C=C(C=C2)[N+](=O)[O-])C/C=C/C(=O)OC

InChI

InChI=1S/C14H14N2O4/c1-9-11(4-3-5-14(17)20-2)12-7-6-10(16(18)19)8-13(12)15-9/h3,5-8,15H,4H2,1-2H3/b5-3+