methyl 3-[[4-[(4-tert-butylphenyl)methyl]piperazin-1-yl]carbonylamino]benzoate

Systemtic Name: methyl 3-[[4-[(4-tert-butylphenyl)methyl]piperazin-1-yl]carbonylamino]benzoate Openeye Name: methyl 3-[[4-[(4-tert-butylphenyl)methyl]piperazine-1-carbonyl]amino]benzoate CAS Name: 3-[[[4-[(4-tert-butylphenyl)methyl]-1-piperazinyl]-oxomethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 3-[[4-[(4-tert-butylphenyl)methyl]piperazine-1-carbonyl]amino]benzoate Traditional Name: 3-[[4-(4-tert-butylbenzyl)piperazine-1-carbonyl]amino]benzoic acid methyl ester Formula: C24H31N3O3 MolecularWeight: 409.52124

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)CN2CCN(CC2)C(=O)NC3=CC=CC(=C3)C(=O)OC

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)CN2CCN(CC2)C(=O)NC3=CC=CC(=C3)C(=O)OC

InChI

InChI=1S/C24H31N3O3/c1-24(2,3)20-10-8-18(9-11-20)17-26-12-14-27(15-13-26)23(29)25-21-7-5-6-19(16-21)22(28)30-4/h5-11,16H,12-15,17H2,1-4H3,(H,25,29)