2-[1-[(4-bromophenyl)methyl]-5-methoxy-2-methyl-indol-3-yl]ethyl 4-chloranylbenzoate

Systemtic Name: 2-[1-[(4-bromophenyl)methyl]-5-methoxy-2-methyl-indol-3-yl]ethyl 4-chloranylbenzoate Openeye Name: 2-[1-[(4-bromophenyl)methyl]-5-methoxy-2-methyl-indol-3-yl]ethyl 4-chlorobenzoate CAS Name: 4-chlorobenzoic acid 2-[1-[(4-bromophenyl)methyl]-5-methoxy-2-methyl-3-indolyl]ethyl ester IUPAC Name: 2-[1-[(4-bromophenyl)methyl]-5-methoxy-2-methylindol-3-yl]ethyl 4-chlorobenzoate Traditional Name: 4-chlorobenzoic acid 2-[1-(4-bromobenzyl)-5-methoxy-2-methyl-indol-3-yl]ethyl ester Formula: C26H23BrClNO3 MolecularWeight: 512.82272

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(N1CC3=CC=C(C=C3)Br)C=CC(=C2)OC)CCOC(=O)C4=CC=C(C=C4)Cl

Isomeric SMILES

CC1=C(C2=C(N1CC3=CC=C(C=C3)Br)C=CC(=C2)OC)CCOC(=O)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C26H23BrClNO3/c1-17-23(13-14-32-26(30)19-5-9-21(28)10-6-19)24-15-22(31-2)11-12-25(24)29(17)16-18-3-7-20(27)8-4-18/h3-12,15H,13-14,16H2,1-2H3