(diphenylmethyl)-[(5R)-3-morpholin-4-ylcarbonyl-1-propyl-4,5,6,7-tetrahydroindazol-5-yl]azanium

Systemtic Name: (diphenylmethyl)-[(5R)-3-morpholin-4-ylcarbonyl-1-propyl-4,5,6,7-tetrahydroindazol-5-yl]azanium Openeye Name: benzhydryl-[(5R)-3-(morpholine-4-carbonyl)-1-propyl-4,5,6,7-tetrahydroindazol-5-yl]ammonium CAS Name: (diphenylmethyl)-[(5R)-3-[4-morpholinyl(oxo)methyl]-1-propyl-4,5,6,7-tetrahydroindazol-5-yl]ammonium IUPAC Name: benzhydryl-[(5R)-3-(morpholine-4-carbonyl)-1-propyl-4,5,6,7-tetrahydroindazol-5-yl]azanium Traditional Name: benzhydryl-[(5R)-3-(morpholine-4-carbonyl)-1-propyl-4,5,6,7-tetrahydroindazol-5-yl]ammonium Formula: C28H35N4O2+ MolecularWeight: 459.6031

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=C(CC(CC2)[NH2+]C(C3=CC=CC=C3)C4=CC=CC=C4)C(=N1)C(=O)N5CCOCC5

Isomeric SMILES

CCCN1C2=C(C[C@@H](CC2)[NH2+]C(C3=CC=CC=C3)C4=CC=CC=C4)C(=N1)C(=O)N5CCOCC5

InChI

InChI=1S/C28H34N4O2/c1-2-15-32-25-14-13-23(20-24(25)27(30-32)28(33)31-16-18-34-19-17-31)29-26(21-9-5-3-6-10-21)22-11-7-4-8-12-22/h3-12,23,26,29H,2,13-20H2,1H3/p+1/t23-/m1/s1