[2-[(4-chloranyl-3-methyl-phenoxy)methyl]-1-methyl-indol-3-yl]methyl 3-chloranylbenzoate

Systemtic Name: [2-[(4-chloranyl-3-methyl-phenoxy)methyl]-1-methyl-indol-3-yl]methyl 3-chloranylbenzoate Openeye Name: [2-[(4-chloro-3-methyl-phenoxy)methyl]-1-methyl-indol-3-yl]methyl 3-chlorobenzoate CAS Name: 3-chlorobenzoic acid [2-[(4-chloro-3-methylphenoxy)methyl]-1-methyl-3-indolyl]methyl ester IUPAC Name: [2-[(4-chloro-3-methylphenoxy)methyl]-1-methylindol-3-yl]methyl 3-chlorobenzoate Traditional Name: 3-chlorobenzoic acid [2-[(4-chloro-3-methyl-phenoxy)methyl]-1-methyl-indol-3-yl]methyl ester Formula: C25H21Cl2NO3 MolecularWeight: 454.34514

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OCC2=C(C3=CC=CC=C3N2C)COC(=O)C4=CC(=CC=C4)Cl)Cl

Isomeric SMILES

CC1=C(C=CC(=C1)OCC2=C(C3=CC=CC=C3N2C)COC(=O)C4=CC(=CC=C4)Cl)Cl

InChI

InChI=1S/C25H21Cl2NO3/c1-16-12-19(10-11-22(16)27)30-15-24-21(20-8-3-4-9-23(20)28(24)2)14-31-25(29)17-6-5-7-18(26)13-17/h3-13H,14-15H2,1-2H3