(3S)-5-(2-chloranyl-5-nitro-phenyl)carbonyloxy-3-(9H-fluoren-9-ylmethoxycarbonylamino)-4-oxidanylidene-pentanoic acid

Systemtic Name: (3S)-5-(2-chloranyl-5-nitro-phenyl)carbonyloxy-3-(9H-fluoren-9-ylmethoxycarbonylamino)-4-oxidanylidene-pentanoic acid Openeye Name: (3S)-5-(2-chloro-5-nitro-benzoyl)oxy-3-(9H-fluoren-9-ylmethoxycarbonylamino)-4-oxo-pentanoic acid CAS Name: (3S)-5-[(2-chloro-5-nitrophenyl)-oxomethoxy]-3-[[9H-fluoren-9-ylmethoxy(oxo)methyl]amino]-4-oxopentanoic acid IUPAC Name: (3S)-5-(2-chloro-5-nitrobenzoyl)oxy-3-(9H-fluoren-9-ylmethoxycarbonylamino)-4-oxopentanoic acid Traditional Name: (3S)-5-(2-chloro-5-nitro-benzoyl)oxy-3-(9H-fluoren-9-ylmethoxycarbonylamino)-4-keto-valeric acid Formula: C27H21ClN2O9 MolecularWeight: 552.91664

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(C3=CC=CC=C32)COC(=O)NC(CC(=O)O)C(=O)COC(=O)C4=C(C=CC(=C4)[N+](=O)[O-])Cl

Isomeric SMILES

C1=CC=C2C(=C1)C(C3=CC=CC=C32)COC(=O)N[C@@H](CC(=O)O)C(=O)COC(=O)C4=C(C=CC(=C4)[N+](=O)[O-])Cl

InChI

InChI=1S/C27H21ClN2O9/c28-22-10-9-15(30(36)37)11-20(22)26(34)38-14-24(31)23(12-25(32)33)29-27(35)39-13-21-18-7-3-1-5-16(18)17-6-2-4-8-19(17)21/h1-11,21,23H,12-14H2,(H,29,35)(H,32,33)/t23-/m0/s1