1-[3-[(4-bromanyl-2-chloranyl-phenyl)carbamoylamino]propanoyl]-N-(4-methoxyphenyl)piperidine-4-carboxamide

Systemtic Name: 1-[3-[(4-bromanyl-2-chloranyl-phenyl)carbamoylamino]propanoyl]-N-(4-methoxyphenyl)piperidine-4-carboxamide Openeye Name: 1-[3-[(4-bromo-2-chloro-phenyl)carbamoylamino]propanoyl]-N-(4-methoxyphenyl)piperidine-4-carboxamide CAS Name: 1-[3-[[(4-bromo-2-chloroanilino)-oxomethyl]amino]-1-oxopropyl]-N-(4-methoxyphenyl)-4-piperidinecarboxamide IUPAC Name: 1-[3-[(4-bromo-2-chlorophenyl)carbamoylamino]propanoyl]-N-(4-methoxyphenyl)piperidine-4-carboxamide Traditional Name: 1-[3-[(4-bromo-2-chloro-phenyl)carbamoylamino]propanoyl]-N-(4-methoxyphenyl)isonipecotamide Formula: C23H26BrClN4O4 MolecularWeight: 537.83394

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NC(=O)C2CCN(CC2)C(=O)CCNC(=O)NC3=C(C=C(C=C3)Br)Cl

Isomeric SMILES

COC1=CC=C(C=C1)NC(=O)C2CCN(CC2)C(=O)CCNC(=O)NC3=C(C=C(C=C3)Br)Cl

InChI

InChI=1S/C23H26BrClN4O4/c1-33-18-5-3-17(4-6-18)27-22(31)15-9-12-29(13-10-15)21(30)8-11-26-23(32)28-20-7-2-16(24)14-19(20)25/h2-7,14-15H,8-13H2,1H3,(H,27,31)(H2,26,28,32)