2-[2-[dipropylcarbamoyl(methyl)amino]ethyl-(methylcarbamoyl)amino]-3-phenyl-propanoic acid

Systemtic Name: 2-[2-[dipropylcarbamoyl(methyl)amino]ethyl-(methylcarbamoyl)amino]-3-phenyl-propanoic acid Openeye Name: 2-[2-[dipropylcarbamoyl(methyl)amino]ethyl-(methylcarbamoyl)amino]-3-phenyl-propanoic acid CAS Name: 2-[2-[[(dipropylamino)-oxomethyl]-methylamino]ethyl-(methylcarbamoyl)amino]-3-phenylpropanoic acid IUPAC Name: 2-[2-[dipropylcarbamoyl(methyl)amino]ethyl-(methylcarbamoyl)amino]-3-phenylpropanoic acid Traditional Name: 2-[2-[dipropylcarbamoyl(methyl)amino]ethyl-(methylcarbamoyl)amino]-3-phenyl-propionic acid Formula: C21H34N4O4 MolecularWeight: 406.51906

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CCC)C(=O)N(C)CCN(C(CC1=CC=CC=C1)C(=O)O)C(=O)NC

Isomeric SMILES

CCCN(CCC)C(=O)N(C)CCN(C(CC1=CC=CC=C1)C(=O)O)C(=O)NC

InChI

InChI=1S/C21H34N4O4/c1-5-12-24(13-6-2)21(29)23(4)14-15-25(20(28)22-3)18(19(26)27)16-17-10-8-7-9-11-17/h7-11,18H,5-6,12-16H2,1-4H3,(H,22,28)(H,26,27)