dimethyl 2-[[1-[(2,5-dimethylphenyl)methyl]pyrrol-2-yl]methylcarbamoylamino]benzene-1,4-dicarboxylate

Systemtic Name: dimethyl 2-[[1-[(2,5-dimethylphenyl)methyl]pyrrol-2-yl]methylcarbamoylamino]benzene-1,4-dicarboxylate Openeye Name: dimethyl 2-[[1-[(2,5-dimethylphenyl)methyl]pyrrol-2-yl]methylcarbamoylamino]benzene-1,4-dicarboxylate CAS Name: 2-[[[[1-[(2,5-dimethylphenyl)methyl]-2-pyrrolyl]methylamino]-oxomethyl]amino]benzene-1,4-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 2-[[1-[(2,5-dimethylphenyl)methyl]pyrrol-2-yl]methylcarbamoylamino]benzene-1,4-dicarboxylate Traditional Name: 2-[[1-(2,5-dimethylbenzyl)pyrrol-2-yl]methylcarbamoylamino]benzene-1,4-dicarboxylic acid dimethyl ester Formula: C25H27N3O5 MolecularWeight: 449.49898

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)CN2C=CC=C2CNC(=O)NC3=C(C=CC(=C3)C(=O)OC)C(=O)OC

Isomeric SMILES

CC1=CC(=C(C=C1)C)CN2C=CC=C2CNC(=O)NC3=C(C=CC(=C3)C(=O)OC)C(=O)OC

InChI

InChI=1S/C25H27N3O5/c1-16-7-8-17(2)19(12-16)15-28-11-5-6-20(28)14-26-25(31)27-22-13-18(23(29)32-3)9-10-21(22)24(30)33-4/h5-13H,14-15H2,1-4H3,(H2,26,27,31)