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2-(5-phenylpentylamino)nonanedioate hydrobromide

2-(5-phenylpentylamino)nonanedioate hydrobromide

Systemtic Name:2-(5-phenylpentylamino)nonanedioate hydrobromide
Openeye Name:2-(5-phenylpentylamino)nonanedioate hydrobromide
CAS Name:2-(5-phenylpentylamino)nonanedioate hydrobromide
IUPAC Name:2-(5-phenylpentylamino)nonanedioate hydrobromide
Traditional Name:2-(5-phenylpentylamino)azelaate hydrobromide
Formula: C20H30BrNO4-2
MolecularWeight: 428.3605
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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCCCCNC(CCCCCCC(=O)[O-])C(=O)[O-].Br


Isomeric SMILES

C1=CC=C(C=C1)CCCCCNC(CCCCCCC(=O)[O-])C(=O)[O-].Br


InChI

InChI=1S/C20H31NO4.BrH/c22-19(23)15-9-2-1-8-14-18(20(24)25)21-16-10-4-7-13-17-11-5-3-6-12-17;/h3,5-6,11-12,18,21H,1-2,4,7-10,13-16H2,(H,22,23)(H,24,25);1H/p-2


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