[(5R)-1-ethyl-3-piperidin-1-ylcarbonyl-4,5,6,7-tetrahydroindazol-5-yl]-prop-2-enyl-azanium

Systemtic Name: [(5R)-1-ethyl-3-piperidin-1-ylcarbonyl-4,5,6,7-tetrahydroindazol-5-yl]-prop-2-enyl-azanium Openeye Name: allyl-[(5R)-1-ethyl-3-(piperidine-1-carbonyl)-4,5,6,7-tetrahydroindazol-5-yl]ammonium CAS Name: [(5R)-1-ethyl-3-[oxo(1-piperidinyl)methyl]-4,5,6,7-tetrahydroindazol-5-yl]-prop-2-enylammonium IUPAC Name: [(5R)-1-ethyl-3-(piperidine-1-carbonyl)-4,5,6,7-tetrahydroindazol-5-yl]-prop-2-enylazanium Traditional Name: allyl-[(5R)-1-ethyl-3-(piperidine-1-carbonyl)-4,5,6,7-tetrahydroindazol-5-yl]ammonium Formula: C18H29N4O+ MolecularWeight: 317.44906

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(CC(CC2)[NH2+]CC=C)C(=N1)C(=O)N3CCCCC3

Isomeric SMILES

CCN1C2=C(C[C@@H](CC2)[NH2+]CC=C)C(=N1)C(=O)N3CCCCC3

InChI

InChI=1S/C18H28N4O/c1-3-10-19-14-8-9-16-15(13-14)17(20-22(16)4-2)18(23)21-11-6-5-7-12-21/h3,14,19H,1,4-13H2,2H3/p+1/t14-/m1/s1