ethyl 4-[[(2S)-2-(2,2-dimethylpropanoylamino)-4-methyl-pentanoyl]amino]benzoate

Systemtic Name: ethyl 4-[[(2S)-2-(2,2-dimethylpropanoylamino)-4-methyl-pentanoyl]amino]benzoate Openeye Name: ethyl 4-[[(2S)-2-(2,2-dimethylpropanoylamino)-4-methyl-pentanoyl]amino]benzoate CAS Name: 4-[[(2S)-2-[(2,2-dimethyl-1-oxopropyl)amino]-4-methyl-1-oxopentyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[(2S)-2-(2,2-dimethylpropanoylamino)-4-methylpentanoyl]amino]benzoate Traditional Name: 4-[[(2S)-4-methyl-2-(pivaloylamino)pentanoyl]amino]benzoic acid ethyl ester Formula: C20H30N2O4 MolecularWeight: 362.4632

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NC(=O)C(CC(C)C)NC(=O)C(C)(C)C

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C

InChI

InChI=1S/C20H30N2O4/c1-7-26-18(24)14-8-10-15(11-9-14)21-17(23)16(12-13(2)3)22-19(25)20(4,5)6/h8-11,13,16H,7,12H2,1-6H3,(H,21,23)(H,22,25)/t16-/m0/s1