4-(azetidin-1-ium-3-ylmethyl)-N-ethyl-N-(phenylmethyl)aniline

Systemtic Name: 4-(azetidin-1-ium-3-ylmethyl)-N-ethyl-N-(phenylmethyl)aniline Openeye Name: 4-(azetidin-1-ium-3-ylmethyl)-N-benzyl-N-ethyl-aniline CAS Name: 4-(3-azetidin-1-iumylmethyl)-N-ethyl-N-(phenylmethyl)aniline IUPAC Name: 4-(azetidin-1-ium-3-ylmethyl)-N-benzyl-N-ethylaniline Traditional Name: [4-(azetidin-1-ium-3-ylmethyl)phenyl]-benzyl-ethyl-amine Formula: C19H25N2+ MolecularWeight: 281.4152

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=CC=CC=C1)C2=CC=C(C=C2)CC3C[NH2+]C3

Isomeric SMILES

CCN(CC1=CC=CC=C1)C2=CC=C(C=C2)CC3C[NH2+]C3

InChI

InChI=1S/C19H24N2/c1-2-21(15-17-6-4-3-5-7-17)19-10-8-16(9-11-19)12-18-13-20-14-18/h3-11,18,20H,2,12-15H2,1H3/p+1