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

Systemtic Name: furan-2-ylmethyl-[(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]-(2-furylmethyl)ammonium CAS Name: 2-furanylmethyl-[(5R)-3-[oxo(1-piperidinyl)methyl]-1-prop-2-enyl-4,5,6,7-tetrahydroindazol-5-yl]ammonium IUPAC Name: furan-2-ylmethyl-[(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]-(2-furfuryl)ammonium Formula: C21H29N4O2+ MolecularWeight: 369.48056

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C2=C(CC(CC2)[NH2+]CC3=CC=CO3)C(=N1)C(=O)N4CCCCC4

Isomeric SMILES

C=CCN1C2=C(C[C@@H](CC2)[NH2+]CC3=CC=CO3)C(=N1)C(=O)N4CCCCC4

InChI

InChI=1S/C21H28N4O2/c1-2-10-25-19-9-8-16(22-15-17-7-6-13-27-17)14-18(19)20(23-25)21(26)24-11-4-3-5-12-24/h2,6-7,13,16,22H,1,3-5,8-12,14-15H2/p+1/t16-/m1/s1