(4-ethoxyphenyl)methyl-[(2S)-3-methyl-2-pyrrolidin-1-yl-butyl]azanium

Systemtic Name: (4-ethoxyphenyl)methyl-[(2S)-3-methyl-2-pyrrolidin-1-yl-butyl]azanium Openeye Name: (4-ethoxyphenyl)methyl-[(2S)-3-methyl-2-pyrrolidin-1-yl-butyl]ammonium CAS Name: (4-ethoxyphenyl)methyl-[(2S)-3-methyl-2-(1-pyrrolidinyl)butyl]ammonium IUPAC Name: (4-ethoxyphenyl)methyl-[(2S)-3-methyl-2-pyrrolidin-1-ylbutyl]azanium Traditional Name: (4-ethoxybenzyl)-[(2S)-3-methyl-2-pyrrolidino-butyl]ammonium Formula: C18H31N2O+ MolecularWeight: 291.45154

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C[NH2+]CC(C(C)C)N2CCCC2

Isomeric SMILES

CCOC1=CC=C(C=C1)C[NH2+]C[C@H](C(C)C)N2CCCC2

InChI

InChI=1S/C18H30N2O/c1-4-21-17-9-7-16(8-10-17)13-19-14-18(15(2)3)20-11-5-6-12-20/h7-10,15,18-19H,4-6,11-14H2,1-3H3/p+1/t18-/m1/s1