(phenylmethyl) 5-(4-chloranylbutoxy)-2-methyl-1H-indole-3-carboxylate

Systemtic Name: (phenylmethyl) 5-(4-chloranylbutoxy)-2-methyl-1H-indole-3-carboxylate Openeye Name: benzyl 5-(4-chlorobutoxy)-2-methyl-1H-indole-3-carboxylate CAS Name: 5-(4-chlorobutoxy)-2-methyl-1H-indole-3-carboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 5-(4-chlorobutoxy)-2-methyl-1H-indole-3-carboxylate Traditional Name: 5-(4-chlorobutoxy)-2-methyl-1H-indole-3-carboxylic acid benzyl ester Formula: C21H22ClNO3 MolecularWeight: 371.85728

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(N1)C=CC(=C2)OCCCCCl)C(=O)OCC3=CC=CC=C3

Isomeric SMILES

CC1=C(C2=C(N1)C=CC(=C2)OCCCCCl)C(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C21H22ClNO3/c1-15-20(21(24)26-14-16-7-3-2-4-8-16)18-13-17(9-10-19(18)23-15)25-12-6-5-11-22/h2-4,7-10,13,23H,5-6,11-12,14H2,1H3