1-[2-[2-[2-azanylethanoyl(phenyl)amino]propanoylamino]-3-phenylmethoxy-propanoyl]pyrrolidine-2-carboxylic acid

Systemtic Name: 1-[2-[2-[2-azanylethanoyl(phenyl)amino]propanoylamino]-3-phenylmethoxy-propanoyl]pyrrolidine-2-carboxylic acid Openeye Name: 1-[2-[2-(N-(2-aminoacetyl)anilino)propanoylamino]-3-benzyloxy-propanoyl]pyrrolidine-2-carboxylic acid CAS Name: 1-[2-[[2-(N-(2-amino-1-oxoethyl)anilino)-1-oxopropyl]amino]-1-oxo-3-phenylmethoxypropyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 1-[2-[2-(N-(2-aminoacetyl)anilino)propanoylamino]-3-phenylmethoxypropanoyl]pyrrolidine-2-carboxylic acid Traditional Name: 1-[3-benzoxy-2-[2-(N-glycylanilino)propanoylamino]propanoyl]proline Formula: C26H32N4O6 MolecularWeight: 496.55548

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC(COCC1=CC=CC=C1)C(=O)N2CCCC2C(=O)O)N(C3=CC=CC=C3)C(=O)CN

Isomeric SMILES

CC(C(=O)NC(COCC1=CC=CC=C1)C(=O)N2CCCC2C(=O)O)N(C3=CC=CC=C3)C(=O)CN

InChI

InChI=1S/C26H32N4O6/c1-18(30(23(31)15-27)20-11-6-3-7-12-20)24(32)28-21(17-36-16-19-9-4-2-5-10-19)25(33)29-14-8-13-22(29)26(34)35/h2-7,9-12,18,21-22H,8,13-17,27H2,1H3,(H,28,32)(H,34,35)