1-[(4-chlorophenyl)methyl]-4-(9H-fluoren-9-ylmethoxycarbonylamino)piperidine-4-carboxylic acid

Systemtic Name: 1-[(4-chlorophenyl)methyl]-4-(9H-fluoren-9-ylmethoxycarbonylamino)piperidine-4-carboxylic acid Openeye Name: 1-[(4-chlorophenyl)methyl]-4-(9H-fluoren-9-ylmethoxycarbonylamino)piperidine-4-carboxylic acid CAS Name: 1-[(4-chlorophenyl)methyl]-4-[[9H-fluoren-9-ylmethoxy(oxo)methyl]amino]-4-piperidinecarboxylic acid IUPAC Name: 1-[(4-chlorophenyl)methyl]-4-(9H-fluoren-9-ylmethoxycarbonylamino)piperidine-4-carboxylic acid Traditional Name: 1-(4-chlorobenzyl)-4-(9H-fluoren-9-ylmethoxycarbonylamino)isonipecotic acid Formula: C28H27ClN2O4 MolecularWeight: 490.97798

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1(C(=O)O)NC(=O)OCC2C3=CC=CC=C3C4=CC=CC=C24)CC5=CC=C(C=C5)Cl

Isomeric SMILES

C1CN(CCC1(C(=O)O)NC(=O)OCC2C3=CC=CC=C3C4=CC=CC=C24)CC5=CC=C(C=C5)Cl

InChI

InChI=1S/C28H27ClN2O4/c29-20-11-9-19(10-12-20)17-31-15-13-28(14-16-31,26(32)33)30-27(34)35-18-25-23-7-3-1-5-21(23)22-6-2-4-8-24(22)25/h1-12,25H,13-18H2,(H,30,34)(H,32,33)