3-(3-azanyl-4-pyrrolidin-1-yl-phenyl)propyl-tert-butyl-azanium

Systemtic Name: 3-(3-azanyl-4-pyrrolidin-1-yl-phenyl)propyl-tert-butyl-azanium Openeye Name: 3-(3-amino-4-pyrrolidin-1-yl-phenyl)propyl-tert-butyl-ammonium CAS Name: 3-[3-amino-4-(1-pyrrolidinyl)phenyl]propyl-tert-butylammonium IUPAC Name: 3-(3-amino-4-pyrrolidin-1-ylphenyl)propyl-tert-butylazanium Traditional Name: 3-(3-amino-4-pyrrolidino-phenyl)propyl-tert-butyl-ammonium Formula: C17H30N3+ MolecularWeight: 276.4402

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)[NH2+]CCCC1=CC(=C(C=C1)N2CCCC2)N

Isomeric SMILES

CC(C)(C)[NH2+]CCCC1=CC(=C(C=C1)N2CCCC2)N

InChI

InChI=1S/C17H29N3/c1-17(2,3)19-10-6-7-14-8-9-16(15(18)13-14)20-11-4-5-12-20/h8-9,13,19H,4-7,10-12,18H2,1-3H3/p+1