ethyl 1-[[4-bromanyl-2-[(3-chloranyl-4-methoxy-phenyl)methylcarbamoyl]phenyl]carbamoyl]piperidine-4-carboxylate

Systemtic Name: ethyl 1-[[4-bromanyl-2-[(3-chloranyl-4-methoxy-phenyl)methylcarbamoyl]phenyl]carbamoyl]piperidine-4-carboxylate Openeye Name: ethyl 1-[[4-bromo-2-[(3-chloro-4-methoxy-phenyl)methylcarbamoyl]phenyl]carbamoyl]piperidine-4-carboxylate CAS Name: 1-[[4-bromo-2-[[(3-chloro-4-methoxyphenyl)methylamino]-oxomethyl]anilino]-oxomethyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[[4-bromo-2-[(3-chloro-4-methoxyphenyl)methylcarbamoyl]phenyl]carbamoyl]piperidine-4-carboxylate Traditional Name: 1-[[4-bromo-2-[(3-chloro-4-methoxy-benzyl)carbamoyl]phenyl]carbamoyl]isonipecotic acid ethyl ester Formula: C24H27BrClN3O5 MolecularWeight: 552.84528

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCN(CC1)C(=O)NC2=C(C=C(C=C2)Br)C(=O)NCC3=CC(=C(C=C3)OC)Cl

Isomeric SMILES

CCOC(=O)C1CCN(CC1)C(=O)NC2=C(C=C(C=C2)Br)C(=O)NCC3=CC(=C(C=C3)OC)Cl

InChI

InChI=1S/C24H27BrClN3O5/c1-3-34-23(31)16-8-10-29(11-9-16)24(32)28-20-6-5-17(25)13-18(20)22(30)27-14-15-4-7-21(33-2)19(26)12-15/h4-7,12-13,16H,3,8-11,14H2,1-2H3,(H,27,30)(H,28,32)