methyl 3-[2-[(4-chloranylphenoxy)methyl]-1-methyl-indol-3-yl]-3-oxidanyl-propanoate

Systemtic Name: methyl 3-[2-[(4-chloranylphenoxy)methyl]-1-methyl-indol-3-yl]-3-oxidanyl-propanoate Openeye Name: methyl 3-[2-[(4-chlorophenoxy)methyl]-1-methyl-indol-3-yl]-3-hydroxy-propanoate CAS Name: 3-[2-[(4-chlorophenoxy)methyl]-1-methyl-3-indolyl]-3-hydroxypropanoic acid methyl ester IUPAC Name: methyl 3-[2-[(4-chlorophenoxy)methyl]-1-methylindol-3-yl]-3-hydroxypropanoate Traditional Name: 3-[2-[(4-chlorophenoxy)methyl]-1-methyl-indol-3-yl]-3-hydroxy-propionic acid methyl ester Formula: C20H20ClNO4 MolecularWeight: 373.8301

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2C(=C1COC3=CC=C(C=C3)Cl)C(CC(=O)OC)O

Isomeric SMILES

CN1C2=CC=CC=C2C(=C1COC3=CC=C(C=C3)Cl)C(CC(=O)OC)O

InChI

InChI=1S/C20H20ClNO4/c1-22-16-6-4-3-5-15(16)20(18(23)11-19(24)25-2)17(22)12-26-14-9-7-13(21)8-10-14/h3-10,18,23H,11-12H2,1-2H3