methyl 3-[[4-(2,5-dimethylphenyl)piperazin-1-yl]carbonylamino]benzoate

Systemtic Name: methyl 3-[[4-(2,5-dimethylphenyl)piperazin-1-yl]carbonylamino]benzoate Openeye Name: methyl 3-[[4-(2,5-dimethylphenyl)piperazine-1-carbonyl]amino]benzoate CAS Name: 3-[[[4-(2,5-dimethylphenyl)-1-piperazinyl]-oxomethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 3-[[4-(2,5-dimethylphenyl)piperazine-1-carbonyl]amino]benzoate Traditional Name: 3-[[4-(2,5-dimethylphenyl)piperazine-1-carbonyl]amino]benzoic acid methyl ester Formula: C21H25N3O3 MolecularWeight: 367.4415

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)N2CCN(CC2)C(=O)NC3=CC=CC(=C3)C(=O)OC

Isomeric SMILES

CC1=CC(=C(C=C1)C)N2CCN(CC2)C(=O)NC3=CC=CC(=C3)C(=O)OC

InChI

InChI=1S/C21H25N3O3/c1-15-7-8-16(2)19(13-15)23-9-11-24(12-10-23)21(26)22-18-6-4-5-17(14-18)20(25)27-3/h4-8,13-14H,9-12H2,1-3H3,(H,22,26)