6-[4-[3-(ethylamino)pyridin-2-yl]piperazin-1-yl]carbonylpyridine-3-carboxylic acid

Systemtic Name: 6-[4-[3-(ethylamino)pyridin-2-yl]piperazin-1-yl]carbonylpyridine-3-carboxylic acid Openeye Name: 6-[4-[3-(ethylamino)-2-pyridyl]piperazine-1-carbonyl]pyridine-3-carboxylic acid CAS Name: 6-[[4-[3-(ethylamino)-2-pyridinyl]-1-piperazinyl]-oxomethyl]-3-pyridinecarboxylic acid IUPAC Name: 6-[4-[3-(ethylamino)pyridin-2-yl]piperazine-1-carbonyl]pyridine-3-carboxylic acid Traditional Name: 6-[4-[3-(ethylamino)-2-pyridyl]piperazine-1-carbonyl]nicotinic acid Formula: C18H21N5O3 MolecularWeight: 355.39104

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Descriptors Computed from Structure

Canonical SMILES:

CCNC1=C(N=CC=C1)N2CCN(CC2)C(=O)C3=NC=C(C=C3)C(=O)O

Isomeric SMILES

CCNC1=C(N=CC=C1)N2CCN(CC2)C(=O)C3=NC=C(C=C3)C(=O)O

InChI

InChI=1S/C18H21N5O3/c1-2-19-14-4-3-7-20-16(14)22-8-10-23(11-9-22)17(24)15-6-5-13(12-21-15)18(25)26/h3-7,12,19H,2,8-11H2,1H3,(H,25,26)