methyl 2-[[(2,2-dimethylpropanoylamino)-(phenylmethyl)carbamoyl]amino]-3-phenyl-propanoate

Systemtic Name: methyl 2-[[(2,2-dimethylpropanoylamino)-(phenylmethyl)carbamoyl]amino]-3-phenyl-propanoate Openeye Name: methyl 2-[[benzyl-(2,2-dimethylpropanoylamino)carbamoyl]amino]-3-phenyl-propanoate CAS Name: 2-[[[[(2,2-dimethyl-1-oxopropyl)amino]-(phenylmethyl)amino]-oxomethyl]amino]-3-phenylpropanoic acid methyl ester IUPAC Name: methyl 2-[[benzyl-(2,2-dimethylpropanoylamino)carbamoyl]amino]-3-phenylpropanoate Traditional Name: 2-[[benzyl-(pivaloylamino)carbamoyl]amino]-3-phenyl-propionic acid methyl ester Formula: C23H29N3O4 MolecularWeight: 411.49406

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)NN(CC1=CC=CC=C1)C(=O)NC(CC2=CC=CC=C2)C(=O)OC

Isomeric SMILES

CC(C)(C)C(=O)NN(CC1=CC=CC=C1)C(=O)NC(CC2=CC=CC=C2)C(=O)OC

InChI

InChI=1S/C23H29N3O4/c1-23(2,3)21(28)25-26(16-18-13-9-6-10-14-18)22(29)24-19(20(27)30-4)15-17-11-7-5-8-12-17/h5-14,19H,15-16H2,1-4H3,(H,24,29)(H,25,28)