2-[2-[[[1-(3-azanyl-4-phenyl-butanoyl)pyrrolidin-2-yl]carbonylamino]methyl]-4-chloranyl-phenoxy]ethanoate

Systemtic Name: 2-[2-[[[1-(3-azanyl-4-phenyl-butanoyl)pyrrolidin-2-yl]carbonylamino]methyl]-4-chloranyl-phenoxy]ethanoate Openeye Name: 2-[2-[[[1-(3-amino-4-phenyl-butanoyl)pyrrolidine-2-carbonyl]amino]methyl]-4-chloro-phenoxy]acetate CAS Name: 2-[2-[[[[1-(3-amino-1-oxo-4-phenylbutyl)-2-pyrrolidinyl]-oxomethyl]amino]methyl]-4-chlorophenoxy]acetate IUPAC Name: 2-[2-[[[1-(3-amino-4-phenylbutanoyl)pyrrolidine-2-carbonyl]amino]methyl]-4-chlorophenoxy]acetate Traditional Name: 2-[2-[[[1-(3-amino-4-phenyl-butanoyl)prolyl]amino]methyl]-4-chloro-phenoxy]acetate Formula: C24H27ClN3O5- MolecularWeight: 472.94128

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(=O)CC(CC2=CC=CC=C2)N)C(=O)NCC3=C(C=CC(=C3)Cl)OCC(=O)[O-]

Isomeric SMILES

C1CC(N(C1)C(=O)CC(CC2=CC=CC=C2)N)C(=O)NCC3=C(C=CC(=C3)Cl)OCC(=O)[O-]

InChI

InChI=1S/C24H28ClN3O5/c25-18-8-9-21(33-15-23(30)31)17(12-18)14-27-24(32)20-7-4-10-28(20)22(29)13-19(26)11-16-5-2-1-3-6-16/h1-3,5-6,8-9,12,19-20H,4,7,10-11,13-15,26H2,(H,27,32)(H,30,31)/p-1