ethyl 2-[[(3-ethoxy-2-oxidanyl-3-oxidanylidene-propyl)-(2-methylpropyl)carbamoyl]amino]-3-phenyl-propanoate

Systemtic Name: ethyl 2-[[(3-ethoxy-2-oxidanyl-3-oxidanylidene-propyl)-(2-methylpropyl)carbamoyl]amino]-3-phenyl-propanoate Openeye Name: ethyl 2-[[(3-ethoxy-2-hydroxy-3-oxo-propyl)-isobutyl-carbamoyl]amino]-3-phenyl-propanoate CAS Name: 2-[[[(3-ethoxy-2-hydroxy-3-oxopropyl)-(2-methylpropyl)amino]-oxomethyl]amino]-3-phenylpropanoic acid ethyl ester IUPAC Name: ethyl 2-[[(3-ethoxy-2-hydroxy-3-oxopropyl)-(2-methylpropyl)carbamoyl]amino]-3-phenylpropanoate Traditional Name: 2-[[(3-ethoxy-2-hydroxy-3-keto-propyl)-isobutyl-carbamoyl]amino]-3-phenyl-propionic acid ethyl ester Formula: C21H32N2O6 MolecularWeight: 408.48858

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CC1=CC=CC=C1)NC(=O)N(CC(C)C)CC(C(=O)OCC)O

Isomeric SMILES

CCOC(=O)C(CC1=CC=CC=C1)NC(=O)N(CC(C)C)CC(C(=O)OCC)O

InChI

InChI=1S/C21H32N2O6/c1-5-28-19(25)17(12-16-10-8-7-9-11-16)22-21(27)23(13-15(3)4)14-18(24)20(26)29-6-2/h7-11,15,17-18,24H,5-6,12-14H2,1-4H3,(H,22,27)