3-[(3-methoxyphenyl)carbonyl-[2-[3-methylbutyl-(2-oxidanylidene-2-phenylazanyl-ethyl)amino]-2-oxidanylidene-ethyl]amino]propanoic acid

Systemtic Name: 3-[(3-methoxyphenyl)carbonyl-[2-[3-methylbutyl-(2-oxidanylidene-2-phenylazanyl-ethyl)amino]-2-oxidanylidene-ethyl]amino]propanoic acid Openeye Name: 3-[[2-[(2-anilino-2-oxo-ethyl)-isopentyl-amino]-2-oxo-ethyl]-(3-methoxybenzoyl)amino]propanoic acid CAS Name: 3-[[2-[(2-anilino-2-oxoethyl)-(3-methylbutyl)amino]-2-oxoethyl]-[(3-methoxyphenyl)-oxomethyl]amino]propanoic acid IUPAC Name: 3-[[2-[(2-anilino-2-oxoethyl)-(3-methylbutyl)amino]-2-oxoethyl]-(3-methoxybenzoyl)amino]propanoic acid Traditional Name: 3-[[2-[(2-anilino-2-keto-ethyl)-isoamyl-amino]-2-keto-ethyl]-m-anisoyl-amino]propionic acid Formula: C26H33N3O6 MolecularWeight: 483.55672

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCN(CC(=O)NC1=CC=CC=C1)C(=O)CN(CCC(=O)O)C(=O)C2=CC(=CC=C2)OC

Isomeric SMILES

CC(C)CCN(CC(=O)NC1=CC=CC=C1)C(=O)CN(CCC(=O)O)C(=O)C2=CC(=CC=C2)OC

InChI

InChI=1S/C26H33N3O6/c1-19(2)12-14-28(17-23(30)27-21-9-5-4-6-10-21)24(31)18-29(15-13-25(32)33)26(34)20-8-7-11-22(16-20)35-3/h4-11,16,19H,12-15,17-18H2,1-3H3,(H,27,30)(H,32,33)