N-[1-(phenylmethyl)piperidin-1-ium-4-yl]-4,5,6,7-tetrahydro-1H-indazole-3-carboxamide

Systemtic Name: N-[1-(phenylmethyl)piperidin-1-ium-4-yl]-4,5,6,7-tetrahydro-1H-indazole-3-carboxamide Openeye Name: N-(1-benzylpiperidin-1-ium-4-yl)-4,5,6,7-tetrahydro-1H-indazole-3-carboxamide CAS Name: N-[1-(phenylmethyl)-4-piperidin-1-iumyl]-4,5,6,7-tetrahydro-1H-indazole-3-carboxamide IUPAC Name: N-(1-benzylpiperidin-1-ium-4-yl)-4,5,6,7-tetrahydro-1H-indazole-3-carboxamide Traditional Name: N-(1-benzylpiperidin-1-ium-4-yl)-4,5,6,7-tetrahydro-1H-indazole-3-carboxamide Formula: C20H27N4O+ MolecularWeight: 339.45458

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C(=NN2)C(=O)NC3CC[NH+](CC3)CC4=CC=CC=C4

Isomeric SMILES

C1CCC2=C(C1)C(=NN2)C(=O)NC3CC[NH+](CC3)CC4=CC=CC=C4

InChI

InChI=1S/C20H26N4O/c25-20(19-17-8-4-5-9-18(17)22-23-19)21-16-10-12-24(13-11-16)14-15-6-2-1-3-7-15/h1-3,6-7,16H,4-5,8-14H2,(H,21,25)(H,22,23)/p+1