methyl 4-[4-(5-chloranyl-2-methyl-1H-indol-3-yl)butoxy]benzoate

Systemtic Name: methyl 4-[4-(5-chloranyl-2-methyl-1H-indol-3-yl)butoxy]benzoate Openeye Name: methyl 4-[4-(5-chloro-2-methyl-1H-indol-3-yl)butoxy]benzoate CAS Name: 4-[4-(5-chloro-2-methyl-1H-indol-3-yl)butoxy]benzoic acid methyl ester IUPAC Name: methyl 4-[4-(5-chloro-2-methyl-1H-indol-3-yl)butoxy]benzoate Traditional Name: 4-[4-(5-chloro-2-methyl-1H-indol-3-yl)butoxy]benzoic acid methyl ester Formula: C21H22ClNO3 MolecularWeight: 371.85728

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(N1)C=CC(=C2)Cl)CCCCOC3=CC=C(C=C3)C(=O)OC

Isomeric SMILES

CC1=C(C2=C(N1)C=CC(=C2)Cl)CCCCOC3=CC=C(C=C3)C(=O)OC

InChI

InChI=1S/C21H22ClNO3/c1-14-18(19-13-16(22)8-11-20(19)23-14)5-3-4-12-26-17-9-6-15(7-10-17)21(24)25-2/h6-11,13,23H,3-5,12H2,1-2H3