methyl 1-(3-bromanyl-4,5-dimethoxy-phenyl)-7-chloranyl-3-[4-(2-hydroxyethyl)piperazin-1-yl]carbonyl-naphthalene-2-carboxylate

Systemtic Name: methyl 1-(3-bromanyl-4,5-dimethoxy-phenyl)-7-chloranyl-3-[4-(2-hydroxyethyl)piperazin-1-yl]carbonyl-naphthalene-2-carboxylate Openeye Name: methyl 1-(3-bromo-4,5-dimethoxy-phenyl)-7-chloro-3-[4-(2-hydroxyethyl)piperazine-1-carbonyl]naphthalene-2-carboxylate CAS Name: 1-(3-bromo-4,5-dimethoxyphenyl)-7-chloro-3-[[4-(2-hydroxyethyl)-1-piperazinyl]-oxomethyl]-2-naphthalenecarboxylic acid methyl ester IUPAC Name: methyl 1-(3-bromo-4,5-dimethoxyphenyl)-7-chloro-3-[4-(2-hydroxyethyl)piperazine-1-carbonyl]naphthalene-2-carboxylate Traditional Name: 1-(3-bromo-4,5-dimethoxy-phenyl)-7-chloro-3-[4-(2-hydroxyethyl)piperazine-1-carbonyl]naphthalene-2-carboxylic acid methyl ester Formula: C27H28BrClN2O6 MolecularWeight: 591.87802

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)C2=C3C=C(C=CC3=CC(=C2C(=O)OC)C(=O)N4CCN(CC4)CCO)Cl)Br)OC

Isomeric SMILES

COC1=C(C(=CC(=C1)C2=C3C=C(C=CC3=CC(=C2C(=O)OC)C(=O)N4CCN(CC4)CCO)Cl)Br)OC

InChI

InChI=1S/C27H28BrClN2O6/c1-35-22-14-17(13-21(28)25(22)36-2)23-19-15-18(29)5-4-16(19)12-20(24(23)27(34)37-3)26(33)31-8-6-30(7-9-31)10-11-32/h4-5,12-15,32H,6-11H2,1-3H3