cyclooctyl-[(3R,5S)-5-(propan-2-ylcarbamoyl)-1-(1-propylpiperidin-4-yl)pyrrolidin-1-ium-3-yl]azanium

Systemtic Name: cyclooctyl-[(3R,5S)-5-(propan-2-ylcarbamoyl)-1-(1-propylpiperidin-4-yl)pyrrolidin-1-ium-3-yl]azanium Openeye Name: cyclooctyl-[(3R,5S)-5-(isopropylcarbamoyl)-1-(1-propyl-4-piperidyl)pyrrolidin-1-ium-3-yl]ammonium CAS Name: cyclooctyl-[(3R,5S)-5-[oxo-(propan-2-ylamino)methyl]-1-(1-propyl-4-piperidinyl)-3-pyrrolidin-1-iumyl]ammonium IUPAC Name: cyclooctyl-[(3R,5S)-5-(propan-2-ylcarbamoyl)-1-(1-propylpiperidin-4-yl)pyrrolidin-1-ium-3-yl]azanium Traditional Name: cyclooctyl-[(3R,5S)-5-(isopropylcarbamoyl)-1-(1-propyl-4-piperidyl)pyrrolidin-1-ium-3-yl]ammonium Formula: C24H48N4O+2 MolecularWeight: 408.66412

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1CCC(CC1)[NH+]2CC(CC2C(=O)NC(C)C)[NH2+]C3CCCCCCC3

Isomeric SMILES

CCCN1CCC(CC1)[NH+]2C[C@@H](C[C@H]2C(=O)NC(C)C)[NH2+]C3CCCCCCC3

InChI

InChI=1S/C24H46N4O/c1-4-14-27-15-12-22(13-16-27)28-18-21(17-23(28)24(29)25-19(2)3)26-20-10-8-6-5-7-9-11-20/h19-23,26H,4-18H2,1-3H3,(H,25,29)/p+2/t21-,23+/m1/s1