(2S,4R)-4-(cycloheptylamino)-N-methyl-1-(1-propylpiperidin-4-yl)pyrrolidin-1-ium-2-carboxamide

Systemtic Name: (2S,4R)-4-(cycloheptylamino)-N-methyl-1-(1-propylpiperidin-4-yl)pyrrolidin-1-ium-2-carboxamide Openeye Name: (2S,4R)-4-(cycloheptylamino)-N-methyl-1-(1-propyl-4-piperidyl)pyrrolidin-1-ium-2-carboxamide CAS Name: (2S,4R)-4-(cycloheptylamino)-N-methyl-1-(1-propyl-4-piperidinyl)-2-pyrrolidin-1-iumcarboxamide IUPAC Name: (2S,4R)-4-(cycloheptylamino)-N-methyl-1-(1-propylpiperidin-4-yl)pyrrolidin-1-ium-2-carboxamide Traditional Name: (2S,4R)-4-(cycloheptylamino)-N-methyl-1-(1-propyl-4-piperidyl)pyrrolidin-1-ium-2-carboxamide Formula: C21H41N4O+ MolecularWeight: 365.57644

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1CCC(CC1)[NH+]2CC(CC2C(=O)NC)NC3CCCCCC3

Isomeric SMILES

CCCN1CCC(CC1)[NH+]2C[C@@H](C[C@H]2C(=O)NC)NC3CCCCCC3

InChI

InChI=1S/C21H40N4O/c1-3-12-24-13-10-19(11-14-24)25-16-18(15-20(25)21(26)22-2)23-17-8-6-4-5-7-9-17/h17-20,23H,3-16H2,1-2H3,(H,22,26)/p+1/t18-,20+/m1/s1