(2S)-5-(9H-fluoren-9-ylcarbonylamino)-2-[(2-methylphenyl)methylamino]-5-oxidanylidene-pentanoic acid

Systemtic Name: (2S)-5-(9H-fluoren-9-ylcarbonylamino)-2-[(2-methylphenyl)methylamino]-5-oxidanylidene-pentanoic acid Openeye Name: (2S)-5-(9H-fluorene-9-carbonylamino)-2-(o-tolylmethylamino)-5-oxo-pentanoic acid CAS Name: (2S)-5-[[9H-fluoren-9-yl(oxo)methyl]amino]-2-[(2-methylphenyl)methylamino]-5-oxopentanoic acid IUPAC Name: (2S)-5-(9H-fluorene-9-carbonylamino)-2-[(2-methylphenyl)methylamino]-5-oxopentanoic acid Traditional Name: (2S)-5-(9H-fluorene-9-carbonylamino)-5-keto-2-[(2-methylbenzyl)amino]valeric acid Formula: C27H26N2O4 MolecularWeight: 442.50634

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CNC(CCC(=O)NC(=O)C2C3=CC=CC=C3C4=CC=CC=C24)C(=O)O

Isomeric SMILES

CC1=CC=CC=C1CN[C@@H](CCC(=O)NC(=O)C2C3=CC=CC=C3C4=CC=CC=C24)C(=O)O

InChI

InChI=1S/C27H26N2O4/c1-17-8-2-3-9-18(17)16-28-23(27(32)33)14-15-24(30)29-26(31)25-21-12-6-4-10-19(21)20-11-5-7-13-22(20)25/h2-13,23,25,28H,14-16H2,1H3,(H,32,33)(H,29,30,31)/t23-/m0/s1