methyl 2-[[3-[ethyl(pyridin-4-ylmethyl)amino]piperidin-1-yl]carbonylamino]benzoate

Systemtic Name: methyl 2-[[3-[ethyl(pyridin-4-ylmethyl)amino]piperidin-1-yl]carbonylamino]benzoate Openeye Name: methyl 2-[[3-[ethyl(4-pyridylmethyl)amino]piperidine-1-carbonyl]amino]benzoate CAS Name: 2-[[[3-[ethyl(pyridin-4-ylmethyl)amino]-1-piperidinyl]-oxomethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 2-[[3-[ethyl(pyridin-4-ylmethyl)amino]piperidine-1-carbonyl]amino]benzoate Traditional Name: 2-[[3-[ethyl(4-pyridylmethyl)amino]piperidine-1-carbonyl]amino]benzoic acid methyl ester Formula: C22H28N4O3 MolecularWeight: 396.48272

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=CC=NC=C1)C2CCCN(C2)C(=O)NC3=CC=CC=C3C(=O)OC

Isomeric SMILES

CCN(CC1=CC=NC=C1)C2CCCN(C2)C(=O)NC3=CC=CC=C3C(=O)OC

InChI

InChI=1S/C22H28N4O3/c1-3-25(15-17-10-12-23-13-11-17)18-7-6-14-26(16-18)22(28)24-20-9-5-4-8-19(20)21(27)29-2/h4-5,8-13,18H,3,6-7,14-16H2,1-2H3,(H,24,28)