methyl 5-[(1-cyclopentylpiperidin-4-yl)methyl-(pyridin-3-ylmethyl)amino]-5-oxidanylidene-pentanoate

Systemtic Name: methyl 5-[(1-cyclopentylpiperidin-4-yl)methyl-(pyridin-3-ylmethyl)amino]-5-oxidanylidene-pentanoate Openeye Name: methyl 5-[(1-cyclopentyl-4-piperidyl)methyl-(3-pyridylmethyl)amino]-5-oxo-pentanoate CAS Name: 5-[(1-cyclopentyl-4-piperidinyl)methyl-(3-pyridinylmethyl)amino]-5-oxopentanoic acid methyl ester IUPAC Name: methyl 5-[(1-cyclopentylpiperidin-4-yl)methyl-(pyridin-3-ylmethyl)amino]-5-oxopentanoate Traditional Name: 5-[(1-cyclopentyl-4-piperidyl)methyl-(3-pyridylmethyl)amino]-5-keto-valeric acid methyl ester Formula: C23H35N3O3 MolecularWeight: 401.5423

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCCC(=O)N(CC1CCN(CC1)C2CCCC2)CC3=CN=CC=C3

Isomeric SMILES

COC(=O)CCCC(=O)N(CC1CCN(CC1)C2CCCC2)CC3=CN=CC=C3

InChI

InChI=1S/C23H35N3O3/c1-29-23(28)10-4-9-22(27)26(18-20-6-5-13-24-16-20)17-19-11-14-25(15-12-19)21-7-2-3-8-21/h5-6,13,16,19,21H,2-4,7-12,14-15,17-18H2,1H3