2-azanyl-7-(4-methoxyphenyl)-2-oxidanyl-4-oxidanylidene-3-(phenylmethoxycarbonylamino)-3-propan-2-yl-heptanoic acid

Systemtic Name: 2-azanyl-7-(4-methoxyphenyl)-2-oxidanyl-4-oxidanylidene-3-(phenylmethoxycarbonylamino)-3-propan-2-yl-heptanoic acid Openeye Name: 2-amino-3-(benzyloxycarbonylamino)-2-hydroxy-3-isopropyl-7-(4-methoxyphenyl)-4-oxo-heptanoic acid CAS Name: 2-amino-2-hydroxy-7-(4-methoxyphenyl)-4-oxo-3-(phenylmethoxycarbonylamino)-3-propan-2-ylheptanoic acid IUPAC Name: 2-amino-2-hydroxy-7-(4-methoxyphenyl)-4-oxo-3-(phenylmethoxycarbonylamino)-3-propan-2-ylheptanoic acid Traditional Name: 2-amino-3-(benzyloxycarbonylamino)-2-hydroxy-3-isopropyl-4-keto-7-(4-methoxyphenyl)enanthic acid Formula: C25H32N2O7 MolecularWeight: 472.53078

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)CCCC1=CC=C(C=C1)OC)(C(C(=O)O)(N)O)NC(=O)OCC2=CC=CC=C2

Isomeric SMILES

CC(C)C(C(=O)CCCC1=CC=C(C=C1)OC)(C(C(=O)O)(N)O)NC(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C25H32N2O7/c1-17(2)24(25(26,32)22(29)30,27-23(31)34-16-19-8-5-4-6-9-19)21(28)11-7-10-18-12-14-20(33-3)15-13-18/h4-6,8-9,12-15,17,32H,7,10-11,16,26H2,1-3H3,(H,27,31)(H,29,30)