methyl 2-[[2,5-dimethyl-1-(3-methylphenyl)pyrrol-3-yl]methylcarbamoylamino]benzoate

Systemtic Name: methyl 2-[[2,5-dimethyl-1-(3-methylphenyl)pyrrol-3-yl]methylcarbamoylamino]benzoate Openeye Name: methyl 2-[[2,5-dimethyl-1-(m-tolyl)pyrrol-3-yl]methylcarbamoylamino]benzoate CAS Name: 2-[[[[2,5-dimethyl-1-(3-methylphenyl)-3-pyrrolyl]methylamino]-oxomethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 2-[[2,5-dimethyl-1-(3-methylphenyl)pyrrol-3-yl]methylcarbamoylamino]benzoate Traditional Name: 2-[[2,5-dimethyl-1-(m-tolyl)pyrrol-3-yl]methylcarbamoylamino]benzoic acid methyl ester Formula: C23H25N3O3 MolecularWeight: 391.4629

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2C(=CC(=C2C)CNC(=O)NC3=CC=CC=C3C(=O)OC)C

Isomeric SMILES

CC1=CC(=CC=C1)N2C(=CC(=C2C)CNC(=O)NC3=CC=CC=C3C(=O)OC)C

InChI

InChI=1S/C23H25N3O3/c1-15-8-7-9-19(12-15)26-16(2)13-18(17(26)3)14-24-23(28)25-21-11-6-5-10-20(21)22(27)29-4/h5-13H,14H2,1-4H3,(H2,24,25,28)