2-[5-[(4-azanylbutanoylamino)methyl]-2-oxidanylidene-1-(3-phenylpropyl)pyrrolidin-3-yl]ethanoic acid

Systemtic Name: 2-[5-[(4-azanylbutanoylamino)methyl]-2-oxidanylidene-1-(3-phenylpropyl)pyrrolidin-3-yl]ethanoic acid Openeye Name: 2-[5-[(4-aminobutanoylamino)methyl]-2-oxo-1-(3-phenylpropyl)pyrrolidin-3-yl]acetic acid CAS Name: 2-[5-[[(4-amino-1-oxobutyl)amino]methyl]-2-oxo-1-(3-phenylpropyl)-3-pyrrolidinyl]acetic acid IUPAC Name: 2-[5-[(4-aminobutanoylamino)methyl]-2-oxo-1-(3-phenylpropyl)pyrrolidin-3-yl]acetic acid Traditional Name: 2-[5-[(4-aminobutanoylamino)methyl]-2-keto-1-(3-phenylpropyl)pyrrolidin-3-yl]acetic acid Formula: C20H29N3O4 MolecularWeight: 375.46196

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C(=O)N(C1CNC(=O)CCCN)CCCC2=CC=CC=C2)CC(=O)O

Isomeric SMILES

C1C(C(=O)N(C1CNC(=O)CCCN)CCCC2=CC=CC=C2)CC(=O)O

InChI

InChI=1S/C20H29N3O4/c21-10-4-9-18(24)22-14-17-12-16(13-19(25)26)20(27)23(17)11-5-8-15-6-2-1-3-7-15/h1-3,6-7,16-17H,4-5,8-14,21H2,(H,22,24)(H,25,26)