(3S)-1-(phenylmethyl)-N-(2-pyrrolidin-1-ium-1-ylethyl)pyrrolidin-1-ium-3-amine

Systemtic Name: (3S)-1-(phenylmethyl)-N-(2-pyrrolidin-1-ium-1-ylethyl)pyrrolidin-1-ium-3-amine Openeye Name: (3S)-1-benzyl-N-(2-pyrrolidin-1-ium-1-ylethyl)pyrrolidin-1-ium-3-amine CAS Name: (3S)-1-(phenylmethyl)-N-[2-(1-pyrrolidin-1-iumyl)ethyl]-3-pyrrolidin-1-iumamine IUPAC Name: (3S)-1-benzyl-N-(2-pyrrolidin-1-ium-1-ylethyl)pyrrolidin-1-ium-3-amine Traditional Name: [(3S)-1-benzylpyrrolidin-1-ium-3-yl]-(2-pyrrolidin-1-ium-1-ylethyl)amine Formula: C17H29N3+2 MolecularWeight: 275.43226

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](C1)CCNC2CC[NH+](C2)CC3=CC=CC=C3

Isomeric SMILES

C1CC[NH+](C1)CCN[C@H]2CC[NH+](C2)CC3=CC=CC=C3

InChI

InChI=1S/C17H27N3/c1-2-6-16(7-3-1)14-20-12-8-17(15-20)18-9-13-19-10-4-5-11-19/h1-3,6-7,17-18H,4-5,8-15H2/p+2/t17-/m0/s1