ethyl (3S)-1-[5-(3-azanylpropanoylamino)pyridin-2-yl]piperidine-3-carboxylate

Systemtic Name: ethyl (3S)-1-[5-(3-azanylpropanoylamino)pyridin-2-yl]piperidine-3-carboxylate Openeye Name: ethyl (3S)-1-[5-(3-aminopropanoylamino)-2-pyridyl]piperidine-3-carboxylate CAS Name: (3S)-1-[5-[(3-amino-1-oxopropyl)amino]-2-pyridinyl]-3-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl (3S)-1-[5-(3-aminopropanoylamino)pyridin-2-yl]piperidine-3-carboxylate Traditional Name: (3S)-1-[5-(3-aminopropanoylamino)-2-pyridyl]nipecotic acid ethyl ester Formula: C16H24N4O3 MolecularWeight: 320.38676

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCCN(C1)C2=NC=C(C=C2)NC(=O)CCN

Isomeric SMILES

CCOC(=O)[C@H]1CCCN(C1)C2=NC=C(C=C2)NC(=O)CCN

InChI

InChI=1S/C16H24N4O3/c1-2-23-16(22)12-4-3-9-20(11-12)14-6-5-13(10-18-14)19-15(21)7-8-17/h5-6,10,12H,2-4,7-9,11,17H2,1H3,(H,19,21)/t12-/m0/s1