methyl 1-(3-bromanyl-4,5-dimethoxy-phenyl)-3-[4-(2-hydroxyethyl)piperazin-1-yl]carbonyl-6,7-dimethoxy-naphthalene-2-carboxylate

Systemtic Name: methyl 1-(3-bromanyl-4,5-dimethoxy-phenyl)-3-[4-(2-hydroxyethyl)piperazin-1-yl]carbonyl-6,7-dimethoxy-naphthalene-2-carboxylate Openeye Name: methyl 1-(3-bromo-4,5-dimethoxy-phenyl)-3-[4-(2-hydroxyethyl)piperazine-1-carbonyl]-6,7-dimethoxy-naphthalene-2-carboxylate CAS Name: 1-(3-bromo-4,5-dimethoxyphenyl)-3-[[4-(2-hydroxyethyl)-1-piperazinyl]-oxomethyl]-6,7-dimethoxy-2-naphthalenecarboxylic acid methyl ester IUPAC Name: methyl 1-(3-bromo-4,5-dimethoxyphenyl)-3-[4-(2-hydroxyethyl)piperazine-1-carbonyl]-6,7-dimethoxynaphthalene-2-carboxylate Traditional Name: 1-(3-bromo-4,5-dimethoxy-phenyl)-3-[4-(2-hydroxyethyl)piperazine-1-carbonyl]-6,7-dimethoxy-naphthalene-2-carboxylic acid methyl ester Formula: C29H33BrN2O8 MolecularWeight: 617.48492

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=CC(=C(C(=C2C=C1OC)C3=CC(=C(C(=C3)Br)OC)OC)C(=O)OC)C(=O)N4CCN(CC4)CCO

Isomeric SMILES

COC1=CC2=CC(=C(C(=C2C=C1OC)C3=CC(=C(C(=C3)Br)OC)OC)C(=O)OC)C(=O)N4CCN(CC4)CCO

InChI

InChI=1S/C29H33BrN2O8/c1-36-22-14-17-12-20(28(34)32-8-6-31(7-9-32)10-11-33)26(29(35)40-5)25(19(17)16-23(22)37-2)18-13-21(30)27(39-4)24(15-18)38-3/h12-16,33H,6-11H2,1-5H3