(phenylmethyl) (4S)-4-(9H-fluoren-9-ylmethoxycarbonylamino)-5-isocyano-pentanoate

Systemtic Name: (phenylmethyl) (4S)-4-(9H-fluoren-9-ylmethoxycarbonylamino)-5-isocyano-pentanoate Openeye Name: benzyl (4S)-4-(9H-fluoren-9-ylmethoxycarbonylamino)-5-isocyano-pentanoate CAS Name: (4S)-4-[[9H-fluoren-9-ylmethoxy(oxo)methyl]amino]-5-isocyanopentanoic acid (phenylmethyl) ester IUPAC Name: benzyl (4S)-4-(9H-fluoren-9-ylmethoxycarbonylamino)-5-isocyanopentanoate Traditional Name: (4S)-4-(9H-fluoren-9-ylmethoxycarbonylamino)-5-isocyano-valeric acid benzyl ester Formula: C28H26N2O4 MolecularWeight: 454.51704

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Descriptors Computed from Structure

Canonical SMILES:

[C-]#[N+]CC(CCC(=O)OCC1=CC=CC=C1)NC(=O)OCC2C3=CC=CC=C3C4=CC=CC=C24

Isomeric SMILES

[C-]#[N+]C[C@H](CCC(=O)OCC1=CC=CC=C1)NC(=O)OCC2C3=CC=CC=C3C4=CC=CC=C24

InChI

InChI=1S/C28H26N2O4/c1-29-17-21(15-16-27(31)33-18-20-9-3-2-4-10-20)30-28(32)34-19-26-24-13-7-5-11-22(24)23-12-6-8-14-25(23)26/h2-14,21,26H,15-19H2,(H,30,32)/t21-/m0/s1