(2-nitrophenyl)methyl 4,6-dimethyl-1H-indole-2-carboxylate

Systemtic Name: (2-nitrophenyl)methyl 4,6-dimethyl-1H-indole-2-carboxylate Openeye Name: (2-nitrophenyl)methyl 4,6-dimethyl-1H-indole-2-carboxylate CAS Name: 4,6-dimethyl-1H-indole-2-carboxylic acid (2-nitrophenyl)methyl ester IUPAC Name: (2-nitrophenyl)methyl 4,6-dimethyl-1H-indole-2-carboxylate Traditional Name: 4,6-dimethyl-1H-indole-2-carboxylic acid (2-nitrobenzyl) ester Formula: C18H16N2O4 MolecularWeight: 324.33064

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C=C(NC2=C1)C(=O)OCC3=CC=CC=C3[N+](=O)[O-])C

Isomeric SMILES

CC1=CC(=C2C=C(NC2=C1)C(=O)OCC3=CC=CC=C3[N+](=O)[O-])C

InChI

InChI=1S/C18H16N2O4/c1-11-7-12(2)14-9-16(19-15(14)8-11)18(21)24-10-13-5-3-4-6-17(13)20(22)23/h3-9,19H,10H2,1-2H3