(3S)-3-(9H-fluoren-9-ylmethoxycarbonylamino)-3-[4-(2-methylpropyl)phenyl]propanoate

Systemtic Name: (3S)-3-(9H-fluoren-9-ylmethoxycarbonylamino)-3-[4-(2-methylpropyl)phenyl]propanoate Openeye Name: (3S)-3-(9H-fluoren-9-ylmethoxycarbonylamino)-3-(4-isobutylphenyl)propanoate CAS Name: (3S)-3-[[9H-fluoren-9-ylmethoxy(oxo)methyl]amino]-3-[4-(2-methylpropyl)phenyl]propanoate IUPAC Name: (3S)-3-(9H-fluoren-9-ylmethoxycarbonylamino)-3-[4-(2-methylpropyl)phenyl]propanoate Traditional Name: (3S)-3-(9H-fluoren-9-ylmethoxycarbonylamino)-3-(4-isobutylphenyl)propionate Formula: C28H28NO4- MolecularWeight: 442.52622

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1=CC=C(C=C1)C(CC(=O)[O-])NC(=O)OCC2C3=CC=CC=C3C4=CC=CC=C24

Isomeric SMILES

CC(C)CC1=CC=C(C=C1)[C@H](CC(=O)[O-])NC(=O)OCC2C3=CC=CC=C3C4=CC=CC=C24

InChI

InChI=1S/C28H29NO4/c1-18(2)15-19-11-13-20(14-12-19)26(16-27(30)31)29-28(32)33-17-25-23-9-5-3-7-21(23)22-8-4-6-10-24(22)25/h3-14,18,25-26H,15-17H2,1-2H3,(H,29,32)(H,30,31)/p-1/t26-/m0/s1