3-indol-1-ylpropyl-[(2S)-octan-2-yl]azanium

Systemtic Name: 3-indol-1-ylpropyl-[(2S)-octan-2-yl]azanium Openeye Name: 3-indol-1-ylpropyl-[(1S)-1-methylheptyl]ammonium CAS Name: 3-(1-indolyl)propyl-[(2S)-octan-2-yl]ammonium IUPAC Name: 3-indol-1-ylpropyl-[(2S)-octan-2-yl]azanium Traditional Name: 3-indol-1-ylpropyl-[(1S)-1-methylheptyl]ammonium Formula: C19H31N2+ MolecularWeight: 287.46284

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(C)[NH2+]CCCN1C=CC2=CC=CC=C21

Isomeric SMILES

CCCCCC[C@H](C)[NH2+]CCCN1C=CC2=CC=CC=C21

InChI

InChI=1S/C19H30N2/c1-3-4-5-6-10-17(2)20-14-9-15-21-16-13-18-11-7-8-12-19(18)21/h7-8,11-13,16-17,20H,3-6,9-10,14-15H2,1-2H3/p+1/t17-/m0/s1