2-(6-methoxynaphthalen-2-yl)-2-[[1-(methylazaniumyl)pyrrolidin-3-yl]methyl]pentanoate

Systemtic Name: 2-(6-methoxynaphthalen-2-yl)-2-[[1-(methylazaniumyl)pyrrolidin-3-yl]methyl]pentanoate Openeye Name: 2-(6-methoxy-2-naphthyl)-2-[[1-(methylammonio)pyrrolidin-3-yl]methyl]pentanoate CAS Name: 2-(6-methoxy-2-naphthalenyl)-2-[[1-(methylammonio)-3-pyrrolidinyl]methyl]pentanoate IUPAC Name: 2-(6-methoxynaphthalen-2-yl)-2-[[1-(methylazaniumyl)pyrrolidin-3-yl]methyl]pentanoate Traditional Name: 2-(6-methoxy-2-naphthyl)-2-[[1-(methylammonio)pyrrolidin-3-yl]methyl]valerate Formula: C22H30N2O3 MolecularWeight: 370.4852

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(CC1CCN(C1)[NH2+]C)(C2=CC3=C(C=C2)C=C(C=C3)OC)C(=O)[O-]

Isomeric SMILES

CCCC(CC1CCN(C1)[NH2+]C)(C2=CC3=C(C=C2)C=C(C=C3)OC)C(=O)[O-]

InChI

InChI=1S/C22H30N2O3/c1-4-10-22(21(25)26,14-16-9-11-24(15-16)23-2)19-7-5-18-13-20(27-3)8-6-17(18)12-19/h5-8,12-13,16,23H,4,9-11,14-15H2,1-3H3,(H,25,26)