tert-butyl 2-[(4-cyanonaphthalen-1-yl)carbamoyl]-4-phenylmethoxy-pyrrolidine-1-carboxylate

Systemtic Name: tert-butyl 2-[(4-cyanonaphthalen-1-yl)carbamoyl]-4-phenylmethoxy-pyrrolidine-1-carboxylate Openeye Name: tert-butyl 4-benzyloxy-2-[(4-cyano-1-naphthyl)carbamoyl]pyrrolidine-1-carboxylate CAS Name: 2-[[(4-cyano-1-naphthalenyl)amino]-oxomethyl]-4-phenylmethoxy-1-pyrrolidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 2-[(4-cyanonaphthalen-1-yl)carbamoyl]-4-phenylmethoxypyrrolidine-1-carboxylate Traditional Name: 4-benzoxy-2-[(4-cyano-1-naphthyl)carbamoyl]pyrrolidine-1-carboxylic acid tert-butyl ester Formula: C28H29N3O4 MolecularWeight: 471.54756

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CC(CC1C(=O)NC2=CC=C(C3=CC=CC=C32)C#N)OCC4=CC=CC=C4

Isomeric SMILES

CC(C)(C)OC(=O)N1CC(CC1C(=O)NC2=CC=C(C3=CC=CC=C32)C#N)OCC4=CC=CC=C4

InChI

InChI=1S/C28H29N3O4/c1-28(2,3)35-27(33)31-17-21(34-18-19-9-5-4-6-10-19)15-25(31)26(32)30-24-14-13-20(16-29)22-11-7-8-12-23(22)24/h4-14,21,25H,15,17-18H2,1-3H3,(H,30,32)