[1-azanyl-5-[4-(phenylmethyl)phenoxy]pentyl]phosphonic acid hydrobromide

Systemtic Name: [1-azanyl-5-[4-(phenylmethyl)phenoxy]pentyl]phosphonic acid hydrobromide Openeye Name: [1-amino-5-(4-benzylphenoxy)pentyl]phosphonic acid hydrobromide CAS Name: [1-amino-5-[4-(phenylmethyl)phenoxy]pentyl]phosphonic acid hydrobromide IUPAC Name: [1-amino-5-(4-benzylphenoxy)pentyl]phosphonic acid hydrobromide Traditional Name: [1-amino-5-(4-benzylphenoxy)pentyl]phosphonic acid hydrobromide Formula: C18H25BrNO4P MolecularWeight: 430.273161

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC2=CC=C(C=C2)OCCCCC(N)P(=O)(O)O.Br

Isomeric SMILES

C1=CC=C(C=C1)CC2=CC=C(C=C2)OCCCCC(N)P(=O)(O)O.Br

InChI

InChI=1S/C18H24NO4P.BrH/c19-18(24(20,21)22)8-4-5-13-23-17-11-9-16(10-12-17)14-15-6-2-1-3-7-15;/h1-3,6-7,9-12,18H,4-5,8,13-14,19H2,(H2,20,21,22);1H