methyl 4-[[(2R)-2-(aminocarbonylamino)-4-methyl-pentanoyl]amino]benzoate

Systemtic Name: methyl 4-[[(2R)-2-(aminocarbonylamino)-4-methyl-pentanoyl]amino]benzoate Openeye Name: methyl 4-[[(2R)-4-methyl-2-ureido-pentanoyl]amino]benzoate CAS Name: 4-[[(2R)-2-(carbamoylamino)-4-methyl-1-oxopentyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-[[(2R)-2-(carbamoylamino)-4-methylpentanoyl]amino]benzoate Traditional Name: 4-[[(2R)-4-methyl-2-ureido-pentanoyl]amino]benzoic acid methyl ester Formula: C15H21N3O4 MolecularWeight: 307.34494

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)NC1=CC=C(C=C1)C(=O)OC)NC(=O)N

Isomeric SMILES

CC(C)C[C@H](C(=O)NC1=CC=C(C=C1)C(=O)OC)NC(=O)N

InChI

InChI=1S/C15H21N3O4/c1-9(2)8-12(18-15(16)21)13(19)17-11-6-4-10(5-7-11)14(20)22-3/h4-7,9,12H,8H2,1-3H3,(H,17,19)(H3,16,18,21)/t12-/m1/s1