(phenylmethyl) (3S)-3-(9H-fluoren-9-ylmethoxycarbonylamino)-4-isocyano-butanoate

Systemtic Name: (phenylmethyl) (3S)-3-(9H-fluoren-9-ylmethoxycarbonylamino)-4-isocyano-butanoate Openeye Name: benzyl (3S)-3-(9H-fluoren-9-ylmethoxycarbonylamino)-4-isocyano-butanoate CAS Name: (3S)-3-[[9H-fluoren-9-ylmethoxy(oxo)methyl]amino]-4-isocyanobutanoic acid (phenylmethyl) ester IUPAC Name: benzyl (3S)-3-(9H-fluoren-9-ylmethoxycarbonylamino)-4-isocyanobutanoate Traditional Name: (3S)-3-(9H-fluoren-9-ylmethoxycarbonylamino)-4-isocyano-butyric acid benzyl ester Formula: C27H24N2O4 MolecularWeight: 440.49046

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H24N2O4/c1-28-16-20(15-26(30)32-17-19-9-3-2-4-10-19)29-27(31)33-18-25-23-13-7-5-11-21(23)22-12-6-8-14-24(22)25/h2-14,20,25H,15-18H2,(H,29,31)/t20-/m0/s1