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

Systemtic Name: methyl 3-[(4-tert-butylphenyl)carbonylamino]-4-[4-(phenylcarbonyl)piperazin-1-yl]benzoate Openeye Name: methyl 4-(4-benzoylpiperazin-1-yl)-3-[(4-tert-butylbenzoyl)amino]benzoate CAS Name: 4-(4-benzoyl-1-piperazinyl)-3-[[(4-tert-butylphenyl)-oxomethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-(4-benzoylpiperazin-1-yl)-3-[(4-tert-butylbenzoyl)amino]benzoate Traditional Name: 4-(4-benzoylpiperazino)-3-[(4-tert-butylbenzoyl)amino]benzoic acid methyl ester Formula: C30H33N3O4 MolecularWeight: 499.60072

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C(=O)NC2=C(C=CC(=C2)C(=O)OC)N3CCN(CC3)C(=O)C4=CC=CC=C4

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C(=O)NC2=C(C=CC(=C2)C(=O)OC)N3CCN(CC3)C(=O)C4=CC=CC=C4

InChI

InChI=1S/C30H33N3O4/c1-30(2,3)24-13-10-21(11-14-24)27(34)31-25-20-23(29(36)37-4)12-15-26(25)32-16-18-33(19-17-32)28(35)22-8-6-5-7-9-22/h5-15,20H,16-19H2,1-4H3,(H,31,34)