(4-azaniumylidene-4-azanyl-butyl)-(phenylmethyl)-propan-2-yl-azanium

Systemtic Name: (4-azaniumylidene-4-azanyl-butyl)-(phenylmethyl)-propan-2-yl-azanium Openeye Name: (4-amino-4-azaniumylidene-butyl)-benzyl-isopropyl-ammonium CAS Name: (4-amino-4-iminiobutyl)-(phenylmethyl)-propan-2-ylammonium IUPAC Name: (4-amino-4-azaniumylidenebutyl)-benzyl-propan-2-ylazanium Traditional Name: (4-amino-4-iminio-butyl)-benzyl-isopropyl-ammonium Formula: C14H25N3+2 MolecularWeight: 235.3684

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)[NH+](CCCC(=[NH2+])N)CC1=CC=CC=C1

Isomeric SMILES

CC(C)[NH+](CCCC(=[NH2+])N)CC1=CC=CC=C1

InChI

InChI=1S/C14H23N3/c1-12(2)17(10-6-9-14(15)16)11-13-7-4-3-5-8-13/h3-5,7-8,12H,6,9-11H2,1-2H3,(H3,15,16)/p+2