2-piperidin-4-yloxyethanoyl 2-[[5-(aminomethyl)pyridin-2-yl]carbonylamino]-3-(4-methoxyphenyl)propanoate

Systemtic Name: 2-piperidin-4-yloxyethanoyl 2-[[5-(aminomethyl)pyridin-2-yl]carbonylamino]-3-(4-methoxyphenyl)propanoate Openeye Name: [2-(4-piperidyloxy)acetyl] 2-[[5-(aminomethyl)pyridine-2-carbonyl]amino]-3-(4-methoxyphenyl)propanoate CAS Name: 2-[[[5-(aminomethyl)-2-pyridinyl]-oxomethyl]amino]-3-(4-methoxyphenyl)propanoic acid [1-oxo-2-(4-piperidinyloxy)ethyl] ester IUPAC Name: (2-piperidin-4-yloxyacetyl) 2-[[5-(aminomethyl)pyridine-2-carbonyl]amino]-3-(4-methoxyphenyl)propanoate Traditional Name: 2-[[5-(aminomethyl)picolinoyl]amino]-3-(4-methoxyphenyl)propionic acid [2-(4-piperidyloxy)acetyl] ester Formula: C24H30N4O6 MolecularWeight: 470.5182

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CC(C(=O)OC(=O)COC2CCNCC2)NC(=O)C3=NC=C(C=C3)CN

Isomeric SMILES

COC1=CC=C(C=C1)CC(C(=O)OC(=O)COC2CCNCC2)NC(=O)C3=NC=C(C=C3)CN

InChI

InChI=1S/C24H30N4O6/c1-32-18-5-2-16(3-6-18)12-21(28-23(30)20-7-4-17(13-25)14-27-20)24(31)34-22(29)15-33-19-8-10-26-11-9-19/h2-7,14,19,21,26H,8-13,15,25H2,1H3,(H,28,30)