ethyl 12-oxidanylidene-12-[[1-(phenylmethyl)piperidin-4-yl]amino]dodecanoate

Systemtic Name: ethyl 12-oxidanylidene-12-[[1-(phenylmethyl)piperidin-4-yl]amino]dodecanoate Openeye Name: ethyl 12-[(1-benzyl-4-piperidyl)amino]-12-oxo-dodecanoate CAS Name: 12-oxo-12-[[1-(phenylmethyl)-4-piperidinyl]amino]dodecanoic acid ethyl ester IUPAC Name: ethyl 12-[(1-benzylpiperidin-4-yl)amino]-12-oxododecanoate Traditional Name: 12-[(1-benzyl-4-piperidyl)amino]-12-keto-lauric acid ethyl ester Formula: C26H42N2O3 MolecularWeight: 430.62328

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCCCCCCCCCC(=O)NC1CCN(CC1)CC2=CC=CC=C2

Isomeric SMILES

CCOC(=O)CCCCCCCCCCC(=O)NC1CCN(CC1)CC2=CC=CC=C2

InChI

InChI=1S/C26H42N2O3/c1-2-31-26(30)17-13-8-6-4-3-5-7-12-16-25(29)27-24-18-20-28(21-19-24)22-23-14-10-9-11-15-23/h9-11,14-15,24H,2-8,12-13,16-22H2,1H3,(H,27,29)