[[3-[(1-methylpiperidin-4-yl)oxycarbamoyl]-2-(2-methylpropyl)hex-5-enoyl]amino] 3-phenylpropanoate

Systemtic Name: [[3-[(1-methylpiperidin-4-yl)oxycarbamoyl]-2-(2-methylpropyl)hex-5-enoyl]amino] 3-phenylpropanoate Openeye Name: [[2-isobutyl-3-[(1-methyl-4-piperidyl)oxycarbamoyl]hex-5-enoyl]amino] 3-phenylpropanoate CAS Name: 3-phenylpropanoic acid [[3-[[(1-methyl-4-piperidinyl)oxyamino]-oxomethyl]-2-(2-methylpropyl)-1-oxohex-5-enyl]amino] ester IUPAC Name: [[3-[(1-methylpiperidin-4-yl)oxycarbamoyl]-2-(2-methylpropyl)hex-5-enoyl]amino] 3-phenylpropanoate Traditional Name: 3-phenylpropionic acid [[2-isobutyl-3-[(1-methyl-4-piperidyl)oxycarbamoyl]hex-5-enoyl]amino] ester Formula: C26H39N3O5 MolecularWeight: 473.60496

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(CC=C)C(=O)NOC1CCN(CC1)C)C(=O)NOC(=O)CCC2=CC=CC=C2

Isomeric SMILES

CC(C)CC(C(CC=C)C(=O)NOC1CCN(CC1)C)C(=O)NOC(=O)CCC2=CC=CC=C2

InChI

InChI=1S/C26H39N3O5/c1-5-9-22(25(31)27-33-21-14-16-29(4)17-15-21)23(18-19(2)3)26(32)28-34-24(30)13-12-20-10-7-6-8-11-20/h5-8,10-11,19,21-23H,1,9,12-18H2,2-4H3,(H,27,31)(H,28,32)