[1-[(4-nonylphenyl)methyl]pyrrolidin-3-yl]phosphonic acid

Systemtic Name: [1-[(4-nonylphenyl)methyl]pyrrolidin-3-yl]phosphonic acid Openeye Name: [1-[(4-nonylphenyl)methyl]pyrrolidin-3-yl]phosphonic acid CAS Name: [1-[(4-nonylphenyl)methyl]-3-pyrrolidinyl]phosphonic acid IUPAC Name: [1-[(4-nonylphenyl)methyl]pyrrolidin-3-yl]phosphonic acid Traditional Name: [1-(4-nonylbenzyl)pyrrolidin-3-yl]phosphonic acid Formula: C20H34NO3P MolecularWeight: 367.462621

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC1=CC=C(C=C1)CN2CCC(C2)P(=O)(O)O

Isomeric SMILES

CCCCCCCCCC1=CC=C(C=C1)CN2CCC(C2)P(=O)(O)O

InChI

InChI=1S/C20H34NO3P/c1-2-3-4-5-6-7-8-9-18-10-12-19(13-11-18)16-21-15-14-20(17-21)25(22,23)24/h10-13,20H,2-9,14-17H2,1H3,(H2,22,23,24)