bis(prop-2-enyl)-[(5S)-1-prop-2-enyl-3-pyrrolidin-1-ylcarbonyl-4,5,6,7-tetrahydroindazol-5-yl]azanium

Systemtic Name: bis(prop-2-enyl)-[(5S)-1-prop-2-enyl-3-pyrrolidin-1-ylcarbonyl-4,5,6,7-tetrahydroindazol-5-yl]azanium Openeye Name: diallyl-[(5S)-1-allyl-3-(pyrrolidine-1-carbonyl)-4,5,6,7-tetrahydroindazol-5-yl]ammonium CAS Name: [(5S)-3-[oxo(1-pyrrolidinyl)methyl]-1-prop-2-enyl-4,5,6,7-tetrahydroindazol-5-yl]-bis(prop-2-enyl)ammonium IUPAC Name: bis(prop-2-enyl)-[(5S)-1-prop-2-enyl-3-(pyrrolidine-1-carbonyl)-4,5,6,7-tetrahydroindazol-5-yl]azanium Traditional Name: diallyl-[(5S)-1-allyl-3-(pyrrolidine-1-carbonyl)-4,5,6,7-tetrahydroindazol-5-yl]ammonium Formula: C21H31N4O+ MolecularWeight: 355.49704

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C2=C(CC(CC2)[NH+](CC=C)CC=C)C(=N1)C(=O)N3CCCC3

Isomeric SMILES

C=CCN1C2=C(C[C@H](CC2)[NH+](CC=C)CC=C)C(=N1)C(=O)N3CCCC3

InChI

InChI=1S/C21H30N4O/c1-4-11-23(12-5-2)17-9-10-19-18(16-17)20(22-25(19)13-6-3)21(26)24-14-7-8-15-24/h4-6,17H,1-3,7-16H2/p+1/t17-/m0/s1