2-(3-methoxy-6-pyridin-4-yl-pyridazin-4-yl)-6-(1-piperidin-2-ylethyl)indole-1-carboxylic acid

Systemtic Name: 2-(3-methoxy-6-pyridin-4-yl-pyridazin-4-yl)-6-(1-piperidin-2-ylethyl)indole-1-carboxylic acid Openeye Name: 2-[3-methoxy-6-(4-pyridyl)pyridazin-4-yl]-6-[1-(2-piperidyl)ethyl]indole-1-carboxylic acid CAS Name: 2-(3-methoxy-6-pyridin-4-yl-4-pyridazinyl)-6-[1-(2-piperidinyl)ethyl]-1-indolecarboxylic acid IUPAC Name: 2-(3-methoxy-6-pyridin-4-ylpyridazin-4-yl)-6-(1-piperidin-2-ylethyl)indole-1-carboxylic acid Traditional Name: 2-[3-methoxy-6-(4-pyridyl)pyridazin-4-yl]-6-[1-(2-piperidyl)ethyl]indole-1-carboxylic acid Formula: C26H27N5O3 MolecularWeight: 457.52428

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1CCCCN1)C2=CC3=C(C=C2)C=C(N3C(=O)O)C4=CC(=NN=C4OC)C5=CC=NC=C5

Isomeric SMILES

CC(C1CCCCN1)C2=CC3=C(C=C2)C=C(N3C(=O)O)C4=CC(=NN=C4OC)C5=CC=NC=C5

InChI

InChI=1S/C26H27N5O3/c1-16(21-5-3-4-10-28-21)18-6-7-19-14-24(31(26(32)33)23(19)13-18)20-15-22(29-30-25(20)34-2)17-8-11-27-12-9-17/h6-9,11-16,21,28H,3-5,10H2,1-2H3,(H,32,33)