[(4S)-4-(3-azanyl-1H-isoindol-2-ium-2-yl)pentyl]-diethyl-azanium

Systemtic Name: [(4S)-4-(3-azanyl-1H-isoindol-2-ium-2-yl)pentyl]-diethyl-azanium Openeye Name: [(4S)-4-(3-amino-1H-isoindol-2-ium-2-yl)pentyl]-diethyl-ammonium CAS Name: [(4S)-4-(3-amino-1H-isoindol-2-ium-2-yl)pentyl]-diethylammonium IUPAC Name: [(4S)-4-(3-amino-1H-isoindol-2-ium-2-yl)pentyl]-diethylazanium Traditional Name: [(4S)-4-(3-amino-1H-isoindol-2-ium-2-yl)pentyl]-diethyl-ammonium Formula: C17H29N3+2 MolecularWeight: 275.43226

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CCCC(C)[N+]1=C(C2=CC=CC=C2C1)N

Isomeric SMILES

CC[NH+](CC)CCC[C@H](C)[N+]1=C(C2=CC=CC=C2C1)N

InChI

InChI=1S/C17H27N3/c1-4-19(5-2)12-8-9-14(3)20-13-15-10-6-7-11-16(15)17(20)18/h6-7,10-11,14,18H,4-5,8-9,12-13H2,1-3H3/p+2/t14-/m0/s1