6-chloranyl-3-[1-[2-(1-propan-2-ylpyrazol-4-yl)ethyl]piperidin-4-yl]-1H-indole; ethanedioic acid

Systemtic Name: 6-chloranyl-3-[1-[2-(1-propan-2-ylpyrazol-4-yl)ethyl]piperidin-4-yl]-1H-indole; ethanedioic acid Openeye Name: 6-chloro-3-[1-[2-(1-isopropylpyrazol-4-yl)ethyl]-4-piperidyl]-1H-indole; oxalic acid CAS Name: 6-chloro-3-[1-[2-(1-propan-2-yl-4-pyrazolyl)ethyl]-4-piperidinyl]-1H-indole; oxalic acid IUPAC Name: 6-chloro-3-[1-[2-(1-propan-2-ylpyrazol-4-yl)ethyl]piperidin-4-yl]-1H-indole; oxalic acid Traditional Name: 6-chloro-3-[1-[2-(1-isopropylpyrazol-4-yl)ethyl]-4-piperidyl]-1H-indole; oxalic acid Formula: C23H29ClN4O4 MolecularWeight: 460.95376

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C=C(C=N1)CCN2CCC(CC2)C3=CNC4=C3C=CC(=C4)Cl.C(=O)(C(=O)O)O

Isomeric SMILES

CC(C)N1C=C(C=N1)CCN2CCC(CC2)C3=CNC4=C3C=CC(=C4)Cl.C(=O)(C(=O)O)O

InChI

InChI=1S/C21H27ClN4.C2H2O4/c1-15(2)26-14-16(12-24-26)5-8-25-9-6-17(7-10-25)20-13-23-21-11-18(22)3-4-19(20)21;3-1(4)2(5)6/h3-4,11-15,17,23H,5-10H2,1-2H3;(H,3,4)(H,5,6)