dimethyl 2-butyl-1H-indole-3,5-dicarboxylate

Systemtic Name: dimethyl 2-butyl-1H-indole-3,5-dicarboxylate Openeye Name: dimethyl 2-butyl-1H-indole-3,5-dicarboxylate CAS Name: 2-butyl-1H-indole-3,5-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 2-butyl-1H-indole-3,5-dicarboxylate Traditional Name: 2-butyl-1H-indole-3,5-dicarboxylic acid dimethyl ester Formula: C16H19NO4 MolecularWeight: 289.32636

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(C2=C(N1)C=CC(=C2)C(=O)OC)C(=O)OC

Isomeric SMILES

CCCCC1=C(C2=C(N1)C=CC(=C2)C(=O)OC)C(=O)OC

InChI

InChI=1S/C16H19NO4/c1-4-5-6-13-14(16(19)21-3)11-9-10(15(18)20-2)7-8-12(11)17-13/h7-9,17H,4-6H2,1-3H3