2-[3-[(8-azanyloctanoylamino)methyl]-2-oxidanylidene-1-(3-phenylpropyl)pyrrolidin-3-yl]ethanoic acid

Systemtic Name: 2-[3-[(8-azanyloctanoylamino)methyl]-2-oxidanylidene-1-(3-phenylpropyl)pyrrolidin-3-yl]ethanoic acid Openeye Name: 2-[3-[(8-aminooctanoylamino)methyl]-2-oxo-1-(3-phenylpropyl)pyrrolidin-3-yl]acetic acid CAS Name: 2-[3-[[(8-amino-1-oxooctyl)amino]methyl]-2-oxo-1-(3-phenylpropyl)-3-pyrrolidinyl]acetic acid IUPAC Name: 2-[3-[(8-aminooctanoylamino)methyl]-2-oxo-1-(3-phenylpropyl)pyrrolidin-3-yl]acetic acid Traditional Name: 2-[3-[(8-aminooctanoylamino)methyl]-2-keto-1-(3-phenylpropyl)pyrrolidin-3-yl]acetic acid Formula: C24H37N3O4 MolecularWeight: 431.56828

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(=O)C1(CC(=O)O)CNC(=O)CCCCCCCN)CCCC2=CC=CC=C2

Isomeric SMILES

C1CN(C(=O)C1(CC(=O)O)CNC(=O)CCCCCCCN)CCCC2=CC=CC=C2

InChI

InChI=1S/C24H37N3O4/c25-15-8-3-1-2-7-13-21(28)26-19-24(18-22(29)30)14-17-27(23(24)31)16-9-12-20-10-5-4-6-11-20/h4-6,10-11H,1-3,7-9,12-19,25H2,(H,26,28)(H,29,30)