1-[(2-chlorophenyl)methyl]-6-methoxycarbonyl-2-propyl-indole-3-carboxylic acid

Systemtic Name: 1-[(2-chlorophenyl)methyl]-6-methoxycarbonyl-2-propyl-indole-3-carboxylic acid Openeye Name: 1-[(2-chlorophenyl)methyl]-6-methoxycarbonyl-2-propyl-indole-3-carboxylic acid CAS Name: 1-[(2-chlorophenyl)methyl]-6-methoxycarbonyl-2-propyl-3-indolecarboxylic acid IUPAC Name: 1-[(2-chlorophenyl)methyl]-6-methoxycarbonyl-2-propylindole-3-carboxylic acid Traditional Name: 6-carbomethoxy-1-(2-chlorobenzyl)-2-propyl-indole-3-carboxylic acid Formula: C21H20ClNO4 MolecularWeight: 385.8408

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C2=C(N1CC3=CC=CC=C3Cl)C=C(C=C2)C(=O)OC)C(=O)O

Isomeric SMILES

CCCC1=C(C2=C(N1CC3=CC=CC=C3Cl)C=C(C=C2)C(=O)OC)C(=O)O

InChI

InChI=1S/C21H20ClNO4/c1-3-6-17-19(20(24)25)15-10-9-13(21(26)27-2)11-18(15)23(17)12-14-7-4-5-8-16(14)22/h4-5,7-11H,3,6,12H2,1-2H3,(H,24,25)