4-azanyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-oxidanylidene-5-phenyl-2-pyrrolidin-2-ylcarbonyl-pentanoic acid

Systemtic Name: 4-azanyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-oxidanylidene-5-phenyl-2-pyrrolidin-2-ylcarbonyl-pentanoic acid Openeye Name: 4-amino-2-(tert-butoxycarbonylamino)-3-oxo-5-phenyl-2-(pyrrolidine-2-carbonyl)pentanoic acid CAS Name: 4-amino-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-3-oxo-2-[oxo(2-pyrrolidinyl)methyl]-5-phenylpentanoic acid IUPAC Name: 4-amino-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-oxo-5-phenyl-2-(pyrrolidine-2-carbonyl)pentanoic acid Traditional Name: 4-amino-2-(tert-butoxycarbonylamino)-3-keto-5-phenyl-2-prolyl-valeric acid Formula: C21H29N3O6 MolecularWeight: 419.47146

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(C(=O)C1CCCN1)(C(=O)C(CC2=CC=CC=C2)N)C(=O)O

Isomeric SMILES

CC(C)(C)OC(=O)NC(C(=O)C1CCCN1)(C(=O)C(CC2=CC=CC=C2)N)C(=O)O

InChI

InChI=1S/C21H29N3O6/c1-20(2,3)30-19(29)24-21(18(27)28,17(26)15-10-7-11-23-15)16(25)14(22)12-13-8-5-4-6-9-13/h4-6,8-9,14-15,23H,7,10-12,22H2,1-3H3,(H,24,29)(H,27,28)