(E)-3-(1-methyl-7-nitro-indol-3-yl)-1-(3,4,5-trimethoxyphenyl)prop-2-en-1-one

Systemtic Name: (E)-3-(1-methyl-7-nitro-indol-3-yl)-1-(3,4,5-trimethoxyphenyl)prop-2-en-1-one Openeye Name: (E)-3-(1-methyl-7-nitro-indol-3-yl)-1-(3,4,5-trimethoxyphenyl)prop-2-en-1-one CAS Name: (E)-3-(1-methyl-7-nitro-3-indolyl)-1-(3,4,5-trimethoxyphenyl)-2-propen-1-one IUPAC Name: (E)-3-(1-methyl-7-nitroindol-3-yl)-1-(3,4,5-trimethoxyphenyl)prop-2-en-1-one Traditional Name: (E)-3-(1-methyl-7-nitro-indol-3-yl)-1-(3,4,5-trimethoxyphenyl)prop-2-en-1-one Formula: C21H20N2O6 MolecularWeight: 396.3933

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C2=C1C(=CC=C2)[N+](=O)[O-])C=CC(=O)C3=CC(=C(C(=C3)OC)OC)OC

Isomeric SMILES

CN1C=C(C2=C1C(=CC=C2)[N+](=O)[O-])/C=C/C(=O)C3=CC(=C(C(=C3)OC)OC)OC

InChI

InChI=1S/C21H20N2O6/c1-22-12-13(15-6-5-7-16(20(15)22)23(25)26)8-9-17(24)14-10-18(27-2)21(29-4)19(11-14)28-3/h5-12H,1-4H3/b9-8+