1-[1-[2-(4-chloranyl-3-methyl-phenoxy)ethyl]indol-3-yl]butan-1-one

Systemtic Name: 1-[1-[2-(4-chloranyl-3-methyl-phenoxy)ethyl]indol-3-yl]butan-1-one Openeye Name: 1-[1-[2-(4-chloro-3-methyl-phenoxy)ethyl]indol-3-yl]butan-1-one CAS Name: 1-[1-[2-(4-chloro-3-methylphenoxy)ethyl]-3-indolyl]-1-butanone IUPAC Name: 1-[1-[2-(4-chloro-3-methylphenoxy)ethyl]indol-3-yl]butan-1-one Traditional Name: 1-[1-[2-(4-chloro-3-methyl-phenoxy)ethyl]indol-3-yl]butan-1-one Formula: C21H22ClNO2 MolecularWeight: 355.85788

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)C1=CN(C2=CC=CC=C21)CCOC3=CC(=C(C=C3)Cl)C

Isomeric SMILES

CCCC(=O)C1=CN(C2=CC=CC=C21)CCOC3=CC(=C(C=C3)Cl)C

InChI

InChI=1S/C21H22ClNO2/c1-3-6-21(24)18-14-23(20-8-5-4-7-17(18)20)11-12-25-16-9-10-19(22)15(2)13-16/h4-5,7-10,13-14H,3,6,11-12H2,1-2H3