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

Systemtic Name: methyl 1-(3-bromanyl-4,5-dimethoxy-phenyl)-3-[4-(2-hydroxyethyl)piperazin-1-yl]carbonyl-6-methoxy-naphthalene-2-carboxylate Openeye Name: methyl 1-(3-bromo-4,5-dimethoxy-phenyl)-3-[4-(2-hydroxyethyl)piperazine-1-carbonyl]-6-methoxy-naphthalene-2-carboxylate CAS Name: 1-(3-bromo-4,5-dimethoxyphenyl)-3-[[4-(2-hydroxyethyl)-1-piperazinyl]-oxomethyl]-6-methoxy-2-naphthalenecarboxylic acid methyl ester IUPAC Name: methyl 1-(3-bromo-4,5-dimethoxyphenyl)-3-[4-(2-hydroxyethyl)piperazine-1-carbonyl]-6-methoxynaphthalene-2-carboxylate Traditional Name: 1-(3-bromo-4,5-dimethoxy-phenyl)-3-[4-(2-hydroxyethyl)piperazine-1-carbonyl]-6-methoxy-naphthalene-2-carboxylic acid methyl ester Formula: C28H31BrN2O7 MolecularWeight: 587.45894

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=CC(=C(C(=C2C=C1)C3=CC(=C(C(=C3)Br)OC)OC)C(=O)OC)C(=O)N4CCN(CC4)CCO

Isomeric SMILES

COC1=CC2=CC(=C(C(=C2C=C1)C3=CC(=C(C(=C3)Br)OC)OC)C(=O)OC)C(=O)N4CCN(CC4)CCO

InChI

InChI=1S/C28H31BrN2O7/c1-35-19-5-6-20-17(13-19)14-21(27(33)31-9-7-30(8-10-31)11-12-32)25(28(34)38-4)24(20)18-15-22(29)26(37-3)23(16-18)36-2/h5-6,13-16,32H,7-12H2,1-4H3