methyl 4-[[[4-(4-phenylpiperidin-1-yl)phenyl]carbonylamino]carbamoyl]benzoate

Systemtic Name: methyl 4-[[[4-(4-phenylpiperidin-1-yl)phenyl]carbonylamino]carbamoyl]benzoate Openeye Name: methyl 4-[[[4-(4-phenyl-1-piperidyl)benzoyl]amino]carbamoyl]benzoate CAS Name: 4-[oxo-[[oxo-[4-(4-phenyl-1-piperidinyl)phenyl]methyl]hydrazo]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[[4-(4-phenylpiperidin-1-yl)benzoyl]amino]carbamoyl]benzoate Traditional Name: 4-[[[4-(4-phenylpiperidino)benzoyl]amino]carbamoyl]benzoic acid methyl ester Formula: C27H27N3O4 MolecularWeight: 457.52098

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)C(=O)NNC(=O)C2=CC=C(C=C2)N3CCC(CC3)C4=CC=CC=C4

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)C(=O)NNC(=O)C2=CC=C(C=C2)N3CCC(CC3)C4=CC=CC=C4

InChI

InChI=1S/C27H27N3O4/c1-34-27(33)23-9-7-21(8-10-23)25(31)28-29-26(32)22-11-13-24(14-12-22)30-17-15-20(16-18-30)19-5-3-2-4-6-19/h2-14,20H,15-18H2,1H3,(H,28,31)(H,29,32)