[2-(2-methoxyethylamino)-2-oxidanylidene-ethyl]-[(2S)-2-(4-methoxyphenyl)-2-pyrrolidin-1-ium-1-yl-ethyl]azanium

Systemtic Name: [2-(2-methoxyethylamino)-2-oxidanylidene-ethyl]-[(2S)-2-(4-methoxyphenyl)-2-pyrrolidin-1-ium-1-yl-ethyl]azanium Openeye Name: [2-(2-methoxyethylamino)-2-oxo-ethyl]-[(2S)-2-(4-methoxyphenyl)-2-pyrrolidin-1-ium-1-yl-ethyl]ammonium CAS Name: [2-(2-methoxyethylamino)-2-oxoethyl]-[(2S)-2-(4-methoxyphenyl)-2-(1-pyrrolidin-1-iumyl)ethyl]ammonium IUPAC Name: [2-(2-methoxyethylamino)-2-oxoethyl]-[(2S)-2-(4-methoxyphenyl)-2-pyrrolidin-1-ium-1-ylethyl]azanium Traditional Name: [2-keto-2-(2-methoxyethylamino)ethyl]-[(2S)-2-(4-methoxyphenyl)-2-pyrrolidin-1-ium-1-yl-ethyl]ammonium Formula: C18H31N3O3+2 MolecularWeight: 337.45704

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Descriptors Computed from Structure

Canonical SMILES:

COCCNC(=O)C[NH2+]CC(C1=CC=C(C=C1)OC)[NH+]2CCCC2

Isomeric SMILES

COCCNC(=O)C[NH2+]C[C@H](C1=CC=C(C=C1)OC)[NH+]2CCCC2

InChI

InChI=1S/C18H29N3O3/c1-23-12-9-20-18(22)14-19-13-17(21-10-3-4-11-21)15-5-7-16(24-2)8-6-15/h5-8,17,19H,3-4,9-14H2,1-2H3,(H,20,22)/p+2/t17-/m1/s1