4-[[(2S,3S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-3-methyl-pentanoyl]oxymethyl]benzoic acid

Systemtic Name: 4-[[(2S,3S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-3-methyl-pentanoyl]oxymethyl]benzoic acid Openeye Name: 4-[[(2S,3S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-3-methyl-pentanoyl]oxymethyl]benzoic acid CAS Name: 4-[[(2S,3S)-2-[[9H-fluoren-9-ylmethoxy(oxo)methyl]amino]-3-methyl-1-oxopentoxy]methyl]benzoic acid IUPAC Name: 4-[[(2S,3S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-3-methylpentanoyl]oxymethyl]benzoic acid Traditional Name: 4-[[(2S,3S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-3-methyl-pentanoyl]oxymethyl]benzoic acid Formula: C29H29NO6 MolecularWeight: 487.54366

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)OCC1=CC=C(C=C1)C(=O)O)NC(=O)OCC2C3=CC=CC=C3C4=CC=CC=C24

Isomeric SMILES

CC[C@H](C)[C@@H](C(=O)OCC1=CC=C(C=C1)C(=O)O)NC(=O)OCC2C3=CC=CC=C3C4=CC=CC=C24

InChI

InChI=1S/C29H29NO6/c1-3-18(2)26(28(33)35-16-19-12-14-20(15-13-19)27(31)32)30-29(34)36-17-25-23-10-6-4-8-21(23)22-9-5-7-11-24(22)25/h4-15,18,25-26H,3,16-17H2,1-2H3,(H,30,34)(H,31,32)/t18-,26-/m0/s1