N-[2-[1-[(8-methoxy-2H-chromen-3-yl)methyl]piperidin-1-ium-4-yl]pyrazol-3-yl]cyclopropanecarboxamide

Systemtic Name: N-[2-[1-[(8-methoxy-2H-chromen-3-yl)methyl]piperidin-1-ium-4-yl]pyrazol-3-yl]cyclopropanecarboxamide Openeye Name: N-[2-[1-[(8-methoxy-2H-chromen-3-yl)methyl]piperidin-1-ium-4-yl]pyrazol-3-yl]cyclopropanecarboxamide CAS Name: N-[2-[1-[(8-methoxy-2H-1-benzopyran-3-yl)methyl]-4-piperidin-1-iumyl]-3-pyrazolyl]cyclopropanecarboxamide IUPAC Name: N-[2-[1-[(8-methoxy-2H-chromen-3-yl)methyl]piperidin-1-ium-4-yl]pyrazol-3-yl]cyclopropanecarboxamide Traditional Name: N-[2-[1-[(8-methoxy-2H-chromen-3-yl)methyl]piperidin-1-ium-4-yl]pyrazol-3-yl]cyclopropanecarboxamide Formula: C23H29N4O3+ MolecularWeight: 409.50136

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC2=C1OCC(=C2)C[NH+]3CCC(CC3)N4C(=CC=N4)NC(=O)C5CC5

Isomeric SMILES

COC1=CC=CC2=C1OCC(=C2)C[NH+]3CCC(CC3)N4C(=CC=N4)NC(=O)C5CC5

InChI

InChI=1S/C23H28N4O3/c1-29-20-4-2-3-18-13-16(15-30-22(18)20)14-26-11-8-19(9-12-26)27-21(7-10-24-27)25-23(28)17-5-6-17/h2-4,7,10,13,17,19H,5-6,8-9,11-12,14-15H2,1H3,(H,25,28)/p+1