4,5-bis(chloranyl)-2-[4-[1-(3-methoxyphenyl)imidazo[1,5-a]pyridin-3-yl]piperidin-1-yl]carbonyl-benzoic acid

Systemtic Name: 4,5-bis(chloranyl)-2-[4-[1-(3-methoxyphenyl)imidazo[1,5-a]pyridin-3-yl]piperidin-1-yl]carbonyl-benzoic acid Openeye Name: 4,5-dichloro-2-[4-[1-(3-methoxyphenyl)imidazo[1,5-a]pyridin-3-yl]piperidine-1-carbonyl]benzoic acid CAS Name: 4,5-dichloro-2-[[4-[1-(3-methoxyphenyl)-3-imidazo[1,5-a]pyridinyl]-1-piperidinyl]-oxomethyl]benzoic acid IUPAC Name: 4,5-dichloro-2-[4-[1-(3-methoxyphenyl)imidazo[1,5-a]pyridin-3-yl]piperidine-1-carbonyl]benzoic acid Traditional Name: 4,5-dichloro-2-[4-[1-(3-methoxyphenyl)imidazo[1,5-a]pyridin-3-yl]piperidine-1-carbonyl]benzoic acid Formula: C27H23Cl2N3O4 MolecularWeight: 524.39522

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C2=C3C=CC=CN3C(=N2)C4CCN(CC4)C(=O)C5=CC(=C(C=C5C(=O)O)Cl)Cl

Isomeric SMILES

COC1=CC=CC(=C1)C2=C3C=CC=CN3C(=N2)C4CCN(CC4)C(=O)C5=CC(=C(C=C5C(=O)O)Cl)Cl

InChI

InChI=1S/C27H23Cl2N3O4/c1-36-18-6-4-5-17(13-18)24-23-7-2-3-10-32(23)25(30-24)16-8-11-31(12-9-16)26(33)19-14-21(28)22(29)15-20(19)27(34)35/h2-7,10,13-16H,8-9,11-12H2,1H3,(H,34,35)