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3-bromanyl-1-[(3-nitrophenyl)methyl]indole-2-carboxylic acid

3-bromanyl-1-[(3-nitrophenyl)methyl]indole-2-carboxylic acid

Systemtic Name:3-bromanyl-1-[(3-nitrophenyl)methyl]indole-2-carboxylic acid
Openeye Name:3-bromo-1-[(3-nitrophenyl)methyl]indole-2-carboxylic acid
CAS Name:3-bromo-1-[(3-nitrophenyl)methyl]-2-indolecarboxylic acid
IUPAC Name:3-bromo-1-[(3-nitrophenyl)methyl]indole-2-carboxylic acid
Traditional Name:3-bromo-1-(3-nitrobenzyl)indole-2-carboxylic acid
Formula: C16H11BrN2O4
MolecularWeight: 375.17354
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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=C(N2CC3=CC(=CC=C3)[N+](=O)[O-])C(=O)O)Br


Isomeric SMILES

C1=CC=C2C(=C1)C(=C(N2CC3=CC(=CC=C3)[N+](=O)[O-])C(=O)O)Br


InChI

InChI=1S/C16H11BrN2O4/c17-14-12-6-1-2-7-13(12)18(15(14)16(20)21)9-10-4-3-5-11(8-10)19(22)23/h1-8H,9H2,(H,20,21)


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