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

Systemtic Name: 2-(cyclohexen-1-yl)ethyl-[(5R)-3-morpholin-4-ylcarbonyl-1-prop-2-enyl-4,5,6,7-tetrahydroindazol-5-yl]azanium Openeye Name: [(5R)-1-allyl-3-(morpholine-4-carbonyl)-4,5,6,7-tetrahydroindazol-5-yl]-[2-(cyclohexen-1-yl)ethyl]ammonium CAS Name: 2-(1-cyclohexenyl)ethyl-[(5R)-3-[4-morpholinyl(oxo)methyl]-1-prop-2-enyl-4,5,6,7-tetrahydroindazol-5-yl]ammonium IUPAC Name: 2-(cyclohexen-1-yl)ethyl-[(5R)-3-(morpholine-4-carbonyl)-1-prop-2-enyl-4,5,6,7-tetrahydroindazol-5-yl]azanium Traditional Name: [(5R)-1-allyl-3-(morpholine-4-carbonyl)-4,5,6,7-tetrahydroindazol-5-yl]-[2-(cyclohexen-1-yl)ethyl]ammonium Formula: C23H35N4O2+ MolecularWeight: 399.5496

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C2=C(CC(CC2)[NH2+]CCC3=CCCCC3)C(=N1)C(=O)N4CCOCC4

Isomeric SMILES

C=CCN1C2=C(C[C@@H](CC2)[NH2+]CCC3=CCCCC3)C(=N1)C(=O)N4CCOCC4

InChI

InChI=1S/C23H34N4O2/c1-2-12-27-21-9-8-19(24-11-10-18-6-4-3-5-7-18)17-20(21)22(25-27)23(28)26-13-15-29-16-14-26/h2,6,19,24H,1,3-5,7-17H2/p+1/t19-/m1/s1