1-[3-chloranyl-4-methoxy-2-methyl-5-(4-phenylbutyl)-6-(2-pyridin-2-ylethoxy)phenyl]ethanone

Systemtic Name: 1-[3-chloranyl-4-methoxy-2-methyl-5-(4-phenylbutyl)-6-(2-pyridin-2-ylethoxy)phenyl]ethanone Openeye Name: 1-[3-chloro-4-methoxy-2-methyl-5-(4-phenylbutyl)-6-[2-(2-pyridyl)ethoxy]phenyl]ethanone CAS Name: 1-[3-chloro-4-methoxy-2-methyl-5-(4-phenylbutyl)-6-[2-(2-pyridinyl)ethoxy]phenyl]ethanone IUPAC Name: 1-[3-chloro-4-methoxy-2-methyl-5-(4-phenylbutyl)-6-(2-pyridin-2-ylethoxy)phenyl]ethanone Traditional Name: 1-[3-chloro-4-methoxy-2-methyl-5-(4-phenylbutyl)-6-[2-(2-pyridyl)ethoxy]phenyl]ethanone Formula: C27H30ClNO3 MolecularWeight: 451.985

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C(=C1Cl)OC)CCCCC2=CC=CC=C2)OCCC3=CC=CC=N3)C(=O)C

Isomeric SMILES

CC1=C(C(=C(C(=C1Cl)OC)CCCCC2=CC=CC=C2)OCCC3=CC=CC=N3)C(=O)C

InChI

InChI=1S/C27H30ClNO3/c1-19-24(20(2)30)26(32-18-16-22-14-9-10-17-29-22)23(27(31-3)25(19)28)15-8-7-13-21-11-5-4-6-12-21/h4-6,9-12,14,17H,7-8,13,15-16,18H2,1-3H3