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

Systemtic Name: cyclohexylmethyl-[(5R)-3-piperidin-1-ylcarbonyl-1-prop-2-enyl-4,5,6,7-tetrahydroindazol-5-yl]azanium Openeye Name: [(5R)-1-allyl-3-(piperidine-1-carbonyl)-4,5,6,7-tetrahydroindazol-5-yl]-(cyclohexylmethyl)ammonium CAS Name: cyclohexylmethyl-[(5R)-3-[oxo(1-piperidinyl)methyl]-1-prop-2-enyl-4,5,6,7-tetrahydroindazol-5-yl]ammonium IUPAC Name: cyclohexylmethyl-[(5R)-3-(piperidine-1-carbonyl)-1-prop-2-enyl-4,5,6,7-tetrahydroindazol-5-yl]azanium Traditional Name: [(5R)-1-allyl-3-(piperidine-1-carbonyl)-4,5,6,7-tetrahydroindazol-5-yl]-(cyclohexylmethyl)ammonium Formula: C23H37N4O+ MolecularWeight: 385.56608

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C2=C(CC(CC2)[NH2+]CC3CCCCC3)C(=N1)C(=O)N4CCCCC4

Isomeric SMILES

C=CCN1C2=C(C[C@@H](CC2)[NH2+]CC3CCCCC3)C(=N1)C(=O)N4CCCCC4

InChI

InChI=1S/C23H36N4O/c1-2-13-27-21-12-11-19(24-17-18-9-5-3-6-10-18)16-20(21)22(25-27)23(28)26-14-7-4-8-15-26/h2,18-19,24H,1,3-17H2/p+1/t19-/m1/s1