tert-butyl 4-[[4-(2,3-dihydroindol-1-ylmethyl)phenyl]methylcarbamoyl]piperidine-1-carboxylate

Systemtic Name: tert-butyl 4-[[4-(2,3-dihydroindol-1-ylmethyl)phenyl]methylcarbamoyl]piperidine-1-carboxylate Openeye Name: tert-butyl 4-[[4-(indolin-1-ylmethyl)phenyl]methylcarbamoyl]piperidine-1-carboxylate CAS Name: 4-[[[4-(2,3-dihydroindol-1-ylmethyl)phenyl]methylamino]-oxomethyl]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[[4-(2,3-dihydroindol-1-ylmethyl)phenyl]methylcarbamoyl]piperidine-1-carboxylate Traditional Name: 4-[[4-(indolin-1-ylmethyl)benzyl]carbamoyl]piperidine-1-carboxylic acid tert-butyl ester Formula: C27H35N3O3 MolecularWeight: 449.5851

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCC(CC1)C(=O)NCC2=CC=C(C=C2)CN3CCC4=CC=CC=C43

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC(CC1)C(=O)NCC2=CC=C(C=C2)CN3CCC4=CC=CC=C43

InChI

InChI=1S/C27H35N3O3/c1-27(2,3)33-26(32)29-15-13-23(14-16-29)25(31)28-18-20-8-10-21(11-9-20)19-30-17-12-22-6-4-5-7-24(22)30/h4-11,23H,12-19H2,1-3H3,(H,28,31)