(phenylmethyl) 2-[(4-phenyldiazenylnaphthalen-1-yl)carbamoyl]pyrrolidine-1-carboxylate

Systemtic Name: (phenylmethyl) 2-[(4-phenyldiazenylnaphthalen-1-yl)carbamoyl]pyrrolidine-1-carboxylate Openeye Name: benzyl 2-[(4-phenylazo-1-naphthyl)carbamoyl]pyrrolidine-1-carboxylate CAS Name: 2-[oxo-[(4-phenyldiazenyl-1-naphthalenyl)amino]methyl]-1-pyrrolidinecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 2-[(4-phenyldiazenylnaphthalen-1-yl)carbamoyl]pyrrolidine-1-carboxylate Traditional Name: 2-[(4-phenylazo-1-naphthyl)carbamoyl]pyrrolidine-1-carboxylic acid benzyl ester Formula: C29H26N4O3 MolecularWeight: 478.54174

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(=O)OCC2=CC=CC=C2)C(=O)NC3=CC=C(C4=CC=CC=C43)N=NC5=CC=CC=C5

Isomeric SMILES

C1CC(N(C1)C(=O)OCC2=CC=CC=C2)C(=O)NC3=CC=C(C4=CC=CC=C43)N=NC5=CC=CC=C5

InChI

InChI=1S/C29H26N4O3/c34-28(27-16-9-19-33(27)29(35)36-20-21-10-3-1-4-11-21)30-25-17-18-26(24-15-8-7-14-23(24)25)32-31-22-12-5-2-6-13-22/h1-8,10-15,17-18,27H,9,16,19-20H2,(H,30,34)