ethyl 2-[[5-(cyclooctylcarbamoyl)-4-oxidanylidene-1-(pyridin-2-ylmethyl)pyridin-3-yl]carbonyl-methyl-amino]ethanoate

Systemtic Name: ethyl 2-[[5-(cyclooctylcarbamoyl)-4-oxidanylidene-1-(pyridin-2-ylmethyl)pyridin-3-yl]carbonyl-methyl-amino]ethanoate Openeye Name: ethyl 2-[[5-(cyclooctylcarbamoyl)-4-oxo-1-(2-pyridylmethyl)pyridine-3-carbonyl]-methyl-amino]acetate CAS Name: 2-[[[5-[(cyclooctylamino)-oxomethyl]-4-oxo-1-(2-pyridinylmethyl)-3-pyridinyl]-oxomethyl]-methylamino]acetic acid ethyl ester IUPAC Name: ethyl 2-[[5-(cyclooctylcarbamoyl)-4-oxo-1-(pyridin-2-ylmethyl)pyridine-3-carbonyl]-methylamino]acetate Traditional Name: 2-[[5-(cyclooctylcarbamoyl)-4-keto-1-(2-pyridylmethyl)nicotinoyl]-methyl-amino]acetic acid ethyl ester Formula: C26H34N4O5 MolecularWeight: 482.57196

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CN(C)C(=O)C1=CN(C=C(C1=O)C(=O)NC2CCCCCCC2)CC3=CC=CC=N3

Isomeric SMILES

CCOC(=O)CN(C)C(=O)C1=CN(C=C(C1=O)C(=O)NC2CCCCCCC2)CC3=CC=CC=N3

InChI

InChI=1S/C26H34N4O5/c1-3-35-23(31)18-29(2)26(34)22-17-30(15-20-13-9-10-14-27-20)16-21(24(22)32)25(33)28-19-11-7-5-4-6-8-12-19/h9-10,13-14,16-17,19H,3-8,11-12,15,18H2,1-2H3,(H,28,33)