(3R)-1-(phenylmethyl)-3-(propylamino)pyrrolidin-1-ium-3-carbonitrile

Systemtic Name: (3R)-1-(phenylmethyl)-3-(propylamino)pyrrolidin-1-ium-3-carbonitrile Openeye Name: (3R)-1-benzyl-3-(propylamino)pyrrolidin-1-ium-3-carbonitrile CAS Name: (3R)-1-(phenylmethyl)-3-(propylamino)-3-pyrrolidin-1-iumcarbonitrile IUPAC Name: (3R)-1-benzyl-3-(propylamino)pyrrolidin-1-ium-3-carbonitrile Traditional Name: (3R)-1-benzyl-3-(propylamino)pyrrolidin-1-ium-3-carbonitrile Formula: C15H22N3+ MolecularWeight: 244.35528

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCNC1(CC[NH+](C1)CC2=CC=CC=C2)C#N

Isomeric SMILES

CCCN[C@@]1(CC[NH+](C1)CC2=CC=CC=C2)C#N

InChI

InChI=1S/C15H21N3/c1-2-9-17-15(12-16)8-10-18(13-15)11-14-6-4-3-5-7-14/h3-7,17H,2,8-11,13H2,1H3/p+1/t15-/m0/s1