dimethyl 2-[2-[4-(naphthalen-1-ylmethyl)piperazin-1-yl]ethanoylamino]benzene-1,4-dicarboxylate

Systemtic Name: dimethyl 2-[2-[4-(naphthalen-1-ylmethyl)piperazin-1-yl]ethanoylamino]benzene-1,4-dicarboxylate Openeye Name: dimethyl 2-[[2-[4-(1-naphthylmethyl)piperazin-1-yl]acetyl]amino]benzene-1,4-dicarboxylate CAS Name: 2-[[2-[4-(1-naphthalenylmethyl)-1-piperazinyl]-1-oxoethyl]amino]benzene-1,4-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 2-[[2-[4-(naphthalen-1-ylmethyl)piperazin-1-yl]acetyl]amino]benzene-1,4-dicarboxylate Traditional Name: 2-[[2-[4-(1-naphthylmethyl)piperazino]acetyl]amino]benzene-1,4-dicarboxylic acid dimethyl ester Formula: C27H29N3O5 MolecularWeight: 475.53626

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=C(C=C1)C(=O)OC)NC(=O)CN2CCN(CC2)CC3=CC=CC4=CC=CC=C43

Isomeric SMILES

COC(=O)C1=CC(=C(C=C1)C(=O)OC)NC(=O)CN2CCN(CC2)CC3=CC=CC4=CC=CC=C43

InChI

InChI=1S/C27H29N3O5/c1-34-26(32)20-10-11-23(27(33)35-2)24(16-20)28-25(31)18-30-14-12-29(13-15-30)17-21-8-5-7-19-6-3-4-9-22(19)21/h3-11,16H,12-15,17-18H2,1-2H3,(H,28,31)