ethyl 2-[[4-[2-(4-butoxyphenyl)ethanoylamino]piperidin-4-yl]carbonylamino]-3-phenyl-propanoate

Systemtic Name: ethyl 2-[[4-[2-(4-butoxyphenyl)ethanoylamino]piperidin-4-yl]carbonylamino]-3-phenyl-propanoate Openeye Name: ethyl 2-[[4-[[2-(4-butoxyphenyl)acetyl]amino]piperidine-4-carbonyl]amino]-3-phenyl-propanoate CAS Name: 2-[[[4-[[2-(4-butoxyphenyl)-1-oxoethyl]amino]-4-piperidinyl]-oxomethyl]amino]-3-phenylpropanoic acid ethyl ester IUPAC Name: ethyl 2-[[4-[[2-(4-butoxyphenyl)acetyl]amino]piperidine-4-carbonyl]amino]-3-phenylpropanoate Traditional Name: 2-[[4-[[2-(4-butoxyphenyl)acetyl]amino]isonipecotoyl]amino]-3-phenyl-propionic acid ethyl ester Formula: C29H39N3O5 MolecularWeight: 509.63706

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)CC(=O)NC2(CCNCC2)C(=O)NC(CC3=CC=CC=C3)C(=O)OCC

Isomeric SMILES

CCCCOC1=CC=C(C=C1)CC(=O)NC2(CCNCC2)C(=O)NC(CC3=CC=CC=C3)C(=O)OCC

InChI

InChI=1S/C29H39N3O5/c1-3-5-19-37-24-13-11-23(12-14-24)21-26(33)32-29(15-17-30-18-16-29)28(35)31-25(27(34)36-4-2)20-22-9-7-6-8-10-22/h6-14,25,30H,3-5,15-21H2,1-2H3,(H,31,35)(H,32,33)