2-tert-butyl-5-(4-hydroxyphenyl)-3-oxidanylidene-2-(phenylmethoxycarbonylamino)-4-[(phenylmethyl)amino]pentanoic acid

Systemtic Name: 2-tert-butyl-5-(4-hydroxyphenyl)-3-oxidanylidene-2-(phenylmethoxycarbonylamino)-4-[(phenylmethyl)amino]pentanoic acid Openeye Name: 4-(benzylamino)-2-(benzyloxycarbonylamino)-2-tert-butyl-5-(4-hydroxyphenyl)-3-oxo-pentanoic acid CAS Name: 2-tert-butyl-5-(4-hydroxyphenyl)-3-oxo-2-(phenylmethoxycarbonylamino)-4-[(phenylmethyl)amino]pentanoic acid IUPAC Name: 4-(benzylamino)-2-tert-butyl-5-(4-hydroxyphenyl)-3-oxo-2-(phenylmethoxycarbonylamino)pentanoic acid Traditional Name: 4-(benzylamino)-2-(benzyloxycarbonylamino)-2-tert-butyl-5-(4-hydroxyphenyl)-3-keto-valeric acid Formula: C30H34N2O6 MolecularWeight: 518.60076

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(C(=O)C(CC1=CC=C(C=C1)O)NCC2=CC=CC=C2)(C(=O)O)NC(=O)OCC3=CC=CC=C3

Isomeric SMILES

CC(C)(C)C(C(=O)C(CC1=CC=C(C=C1)O)NCC2=CC=CC=C2)(C(=O)O)NC(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C30H34N2O6/c1-29(2,3)30(27(35)36,32-28(37)38-20-23-12-8-5-9-13-23)26(34)25(18-21-14-16-24(33)17-15-21)31-19-22-10-6-4-7-11-22/h4-17,25,31,33H,18-20H2,1-3H3,(H,32,37)(H,35,36)