2-chloranyl-N-[2-[1-[(1-methylindol-3-yl)methyl]piperidin-1-ium-4-yl]pyrazol-3-yl]benzamide

Systemtic Name: 2-chloranyl-N-[2-[1-[(1-methylindol-3-yl)methyl]piperidin-1-ium-4-yl]pyrazol-3-yl]benzamide Openeye Name: 2-chloro-N-[2-[1-[(1-methylindol-3-yl)methyl]piperidin-1-ium-4-yl]pyrazol-3-yl]benzamide CAS Name: 2-chloro-N-[2-[1-[(1-methyl-3-indolyl)methyl]-4-piperidin-1-iumyl]-3-pyrazolyl]benzamide IUPAC Name: 2-chloro-N-[2-[1-[(1-methylindol-3-yl)methyl]piperidin-1-ium-4-yl]pyrazol-3-yl]benzamide Traditional Name: 2-chloro-N-[2-[1-[(1-methylindol-3-yl)methyl]piperidin-1-ium-4-yl]pyrazol-3-yl]benzamide Formula: C25H27ClN5O+ MolecularWeight: 448.96778

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C2=CC=CC=C21)C[NH+]3CCC(CC3)N4C(=CC=N4)NC(=O)C5=CC=CC=C5Cl

Isomeric SMILES

CN1C=C(C2=CC=CC=C21)C[NH+]3CCC(CC3)N4C(=CC=N4)NC(=O)C5=CC=CC=C5Cl

InChI

InChI=1S/C25H26ClN5O/c1-29-16-18(20-6-3-5-9-23(20)29)17-30-14-11-19(12-15-30)31-24(10-13-27-31)28-25(32)21-7-2-4-8-22(21)26/h2-10,13,16,19H,11-12,14-15,17H2,1H3,(H,28,32)/p+1