methyl 3-[[4-(2,6-dimethylphenyl)piperazin-1-yl]carbonylamino]benzoate

Systemtic Name: methyl 3-[[4-(2,6-dimethylphenyl)piperazin-1-yl]carbonylamino]benzoate Openeye Name: methyl 3-[[4-(2,6-dimethylphenyl)piperazine-1-carbonyl]amino]benzoate CAS Name: 3-[[[4-(2,6-dimethylphenyl)-1-piperazinyl]-oxomethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 3-[[4-(2,6-dimethylphenyl)piperazine-1-carbonyl]amino]benzoate Traditional Name: 3-[[4-(2,6-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=C(C(=CC=C1)C)N2CCN(CC2)C(=O)NC3=CC=CC(=C3)C(=O)OC

Isomeric SMILES

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

InChI

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