ethyl 3-[4-[[3-(4-cyano-1-propan-2-yl-piperidin-4-yl)-4-methoxy-phenyl]carbamoyl]phenyl]benzoate

Systemtic Name: ethyl 3-[4-[[3-(4-cyano-1-propan-2-yl-piperidin-4-yl)-4-methoxy-phenyl]carbamoyl]phenyl]benzoate Openeye Name: ethyl 3-[4-[[3-(4-cyano-1-isopropyl-4-piperidyl)-4-methoxy-phenyl]carbamoyl]phenyl]benzoate CAS Name: 3-[4-[[3-(4-cyano-1-propan-2-yl-4-piperidinyl)-4-methoxyanilino]-oxomethyl]phenyl]benzoic acid ethyl ester IUPAC Name: ethyl 3-[4-[[3-(4-cyano-1-propan-2-ylpiperidin-4-yl)-4-methoxyphenyl]carbamoyl]phenyl]benzoate Traditional Name: 3-[4-[[3-(4-cyano-1-isopropyl-4-piperidyl)-4-methoxy-phenyl]carbamoyl]phenyl]benzoic acid ethyl ester Formula: C32H35N3O4 MolecularWeight: 525.638

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=CC(=C1)C2=CC=C(C=C2)C(=O)NC3=CC(=C(C=C3)OC)C4(CCN(CC4)C(C)C)C#N

Isomeric SMILES

CCOC(=O)C1=CC=CC(=C1)C2=CC=C(C=C2)C(=O)NC3=CC(=C(C=C3)OC)C4(CCN(CC4)C(C)C)C#N

InChI

InChI=1S/C32H35N3O4/c1-5-39-31(37)26-8-6-7-25(19-26)23-9-11-24(12-10-23)30(36)34-27-13-14-29(38-4)28(20-27)32(21-33)15-17-35(18-16-32)22(2)3/h6-14,19-20,22H,5,15-18H2,1-4H3,(H,34,36)