heptan-4-yl-[(2R)-4-phenylbutan-2-yl]azanium

Systemtic Name: heptan-4-yl-[(2R)-4-phenylbutan-2-yl]azanium Openeye Name: [(1R)-1-methyl-3-phenyl-propyl]-(1-propylbutyl)ammonium CAS Name: heptan-4-yl-[(2R)-4-phenylbutan-2-yl]ammonium IUPAC Name: heptan-4-yl-[(2R)-4-phenylbutan-2-yl]azanium Traditional Name: [(1R)-1-methyl-3-phenyl-propyl]-(1-propylbutyl)ammonium Formula: C17H30N+ MolecularWeight: 248.4268

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC(CCC)[NH2+]C(C)CCC1=CC=CC=C1

Isomeric SMILES

CCCC(CCC)[NH2+][C@H](C)CCC1=CC=CC=C1

InChI

InChI=1S/C17H29N/c1-4-9-17(10-5-2)18-15(3)13-14-16-11-7-6-8-12-16/h6-8,11-12,15,17-18H,4-5,9-10,13-14H2,1-3H3/p+1/t15-/m1/s1