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

Systemtic Name: methyl 1-(3-bromanyl-4,5-dimethoxy-phenyl)-3-[4-(2-hydroxyethyl)piperazin-1-yl]carbonyl-7-methyl-naphthalene-2-carboxylate Openeye Name: methyl 1-(3-bromo-4,5-dimethoxy-phenyl)-3-[4-(2-hydroxyethyl)piperazine-1-carbonyl]-7-methyl-naphthalene-2-carboxylate CAS Name: 1-(3-bromo-4,5-dimethoxyphenyl)-3-[[4-(2-hydroxyethyl)-1-piperazinyl]-oxomethyl]-7-methyl-2-naphthalenecarboxylic acid methyl ester IUPAC Name: methyl 1-(3-bromo-4,5-dimethoxyphenyl)-3-[4-(2-hydroxyethyl)piperazine-1-carbonyl]-7-methylnaphthalene-2-carboxylate Traditional Name: 1-(3-bromo-4,5-dimethoxy-phenyl)-3-[4-(2-hydroxyethyl)piperazine-1-carbonyl]-7-methyl-naphthalene-2-carboxylic acid methyl ester Formula: C28H31BrN2O6 MolecularWeight: 571.45954

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C(=C(C=C2C=C1)C(=O)N3CCN(CC3)CCO)C(=O)OC)C4=CC(=C(C(=C4)Br)OC)OC

Isomeric SMILES

CC1=CC2=C(C(=C(C=C2C=C1)C(=O)N3CCN(CC3)CCO)C(=O)OC)C4=CC(=C(C(=C4)Br)OC)OC

InChI

InChI=1S/C28H31BrN2O6/c1-17-5-6-18-14-21(27(33)31-9-7-30(8-10-31)11-12-32)25(28(34)37-4)24(20(18)13-17)19-15-22(29)26(36-3)23(16-19)35-2/h5-6,13-16,32H,7-12H2,1-4H3