tert-butyl (2S)-2-[(2-azanylethanoylamino)-(4-methylpentanoyl)amino]-5-phenyl-pentanoate

Systemtic Name: tert-butyl (2S)-2-[(2-azanylethanoylamino)-(4-methylpentanoyl)amino]-5-phenyl-pentanoate Openeye Name: tert-butyl (2S)-2-[[(2-aminoacetyl)amino]-(4-methylpentanoyl)amino]-5-phenyl-pentanoate CAS Name: (2S)-2-[[(2-amino-1-oxoethyl)amino]-(4-methyl-1-oxopentyl)amino]-5-phenylpentanoic acid tert-butyl ester IUPAC Name: tert-butyl (2S)-2-[[(2-aminoacetyl)amino]-(4-methylpentanoyl)amino]-5-phenylpentanoate Traditional Name: (2S)-2-[(glycylamino)-(4-methylpentanoyl)amino]-5-phenyl-valeric acid tert-butyl ester Formula: C23H37N3O4 MolecularWeight: 419.55758

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCC(=O)N(C(CCCC1=CC=CC=C1)C(=O)OC(C)(C)C)NC(=O)CN

Isomeric SMILES

CC(C)CCC(=O)N([C@@H](CCCC1=CC=CC=C1)C(=O)OC(C)(C)C)NC(=O)CN

InChI

InChI=1S/C23H37N3O4/c1-17(2)14-15-21(28)26(25-20(27)16-24)19(22(29)30-23(3,4)5)13-9-12-18-10-7-6-8-11-18/h6-8,10-11,17,19H,9,12-16,24H2,1-5H3,(H,25,27)/t19-/m0/s1