4-azanyl-2-[[4-methyl-2-(phenylmethoxycarbonylamino)pentanoyl]amino]-4-oxidanylidene-butanoic acid

Systemtic Name: 4-azanyl-2-[[4-methyl-2-(phenylmethoxycarbonylamino)pentanoyl]amino]-4-oxidanylidene-butanoic acid Openeye Name: 4-amino-2-[[2-(benzyloxycarbonylamino)-4-methyl-pentanoyl]amino]-4-oxo-butanoic acid CAS Name: 4-amino-2-[[4-methyl-1-oxo-2-(phenylmethoxycarbonylamino)pentyl]amino]-4-oxobutanoic acid IUPAC Name: 4-amino-2-[[4-methyl-2-(phenylmethoxycarbonylamino)pentanoyl]amino]-4-oxobutanoic acid Traditional Name: 4-amino-2-[[2-(benzyloxycarbonylamino)-4-methyl-pentanoyl]amino]-4-keto-butyric acid Formula: C18H25N3O6 MolecularWeight: 379.4076

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)NC(CC(=O)N)C(=O)O)NC(=O)OCC1=CC=CC=C1

Isomeric SMILES

CC(C)CC(C(=O)NC(CC(=O)N)C(=O)O)NC(=O)OCC1=CC=CC=C1

InChI

InChI=1S/C18H25N3O6/c1-11(2)8-13(16(23)20-14(17(24)25)9-15(19)22)21-18(26)27-10-12-6-4-3-5-7-12/h3-7,11,13-14H,8-10H2,1-2H3,(H2,19,22)(H,20,23)(H,21,26)(H,24,25)