(2-nitrophenyl)methyl 3-chloranyl-1H-indole-2-carboxylate

Systemtic Name: (2-nitrophenyl)methyl 3-chloranyl-1H-indole-2-carboxylate Openeye Name: (2-nitrophenyl)methyl 3-chloro-1H-indole-2-carboxylate CAS Name: 3-chloro-1H-indole-2-carboxylic acid (2-nitrophenyl)methyl ester IUPAC Name: (2-nitrophenyl)methyl 3-chloro-1H-indole-2-carboxylate Traditional Name: 3-chloro-1H-indole-2-carboxylic acid (2-nitrobenzyl) ester Formula: C16H11ClN2O4 MolecularWeight: 330.72254

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)COC(=O)C2=C(C3=CC=CC=C3N2)Cl)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C(=C1)COC(=O)C2=C(C3=CC=CC=C3N2)Cl)[N+](=O)[O-]

InChI

InChI=1S/C16H11ClN2O4/c17-14-11-6-2-3-7-12(11)18-15(14)16(20)23-9-10-5-1-4-8-13(10)19(21)22/h1-8,18H,9H2