methyl 5-cyano-2-[4-[[1-(5-methyl-2-propan-2-yloxy-phenyl)piperidin-4-yl]methylcarbamoyl]phenyl]-1,3-benzoxazole-7-carboxylate

Systemtic Name: methyl 5-cyano-2-[4-[[1-(5-methyl-2-propan-2-yloxy-phenyl)piperidin-4-yl]methylcarbamoyl]phenyl]-1,3-benzoxazole-7-carboxylate Openeye Name: methyl 5-cyano-2-[4-[[1-(2-isopropoxy-5-methyl-phenyl)-4-piperidyl]methylcarbamoyl]phenyl]-1,3-benzoxazole-7-carboxylate CAS Name: 5-cyano-2-[4-[[[1-(5-methyl-2-propan-2-yloxyphenyl)-4-piperidinyl]methylamino]-oxomethyl]phenyl]-1,3-benzoxazole-7-carboxylic acid methyl ester IUPAC Name: methyl 5-cyano-2-[4-[[1-(5-methyl-2-propan-2-yloxyphenyl)piperidin-4-yl]methylcarbamoyl]phenyl]-1,3-benzoxazole-7-carboxylate Traditional Name: 5-cyano-2-[4-[[1-(2-isopropoxy-5-methyl-phenyl)-4-piperidyl]methylcarbamoyl]phenyl]-1,3-benzoxazole-7-carboxylic acid methyl ester Formula: C33H34N4O5 MolecularWeight: 566.64686

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC(C)C)N2CCC(CC2)CNC(=O)C3=CC=C(C=C3)C4=NC5=CC(=CC(=C5O4)C(=O)OC)C#N

Isomeric SMILES

CC1=CC(=C(C=C1)OC(C)C)N2CCC(CC2)CNC(=O)C3=CC=C(C=C3)C4=NC5=CC(=CC(=C5O4)C(=O)OC)C#N

InChI

InChI=1S/C33H34N4O5/c1-20(2)41-29-10-5-21(3)15-28(29)37-13-11-22(12-14-37)19-35-31(38)24-6-8-25(9-7-24)32-36-27-17-23(18-34)16-26(30(27)42-32)33(39)40-4/h5-10,15-17,20,22H,11-14,19H2,1-4H3,(H,35,38)