tert-butyl 6-[(1-phenylmethoxycarbonylpyrrolidin-3-yl)carbamoyl]indole-1-carboxylate

Systemtic Name: tert-butyl 6-[(1-phenylmethoxycarbonylpyrrolidin-3-yl)carbamoyl]indole-1-carboxylate Openeye Name: tert-butyl 6-[(1-benzyloxycarbonylpyrrolidin-3-yl)carbamoyl]indole-1-carboxylate CAS Name: 6-[oxo-[(1-phenylmethoxycarbonyl-3-pyrrolidinyl)amino]methyl]-1-indolecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 6-[(1-phenylmethoxycarbonylpyrrolidin-3-yl)carbamoyl]indole-1-carboxylate Traditional Name: 6-[(1-carbobenzoxypyrrolidin-3-yl)carbamoyl]indole-1-carboxylic acid tert-butyl ester Formula: C26H29N3O5 MolecularWeight: 463.52556

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1C=CC2=C1C=C(C=C2)C(=O)NC3CCN(C3)C(=O)OCC4=CC=CC=C4

Isomeric SMILES

CC(C)(C)OC(=O)N1C=CC2=C1C=C(C=C2)C(=O)NC3CCN(C3)C(=O)OCC4=CC=CC=C4

InChI

InChI=1S/C26H29N3O5/c1-26(2,3)34-25(32)29-14-11-19-9-10-20(15-22(19)29)23(30)27-21-12-13-28(16-21)24(31)33-17-18-7-5-4-6-8-18/h4-11,14-15,21H,12-13,16-17H2,1-3H3,(H,27,30)