tert-butyl 4-[1-[(2-oxidanyl-1-phenyl-ethyl)carbamoyl]-2,3-dihydroinden-1-yl]piperazine-1-carboxylate

Systemtic Name: tert-butyl 4-[1-[(2-oxidanyl-1-phenyl-ethyl)carbamoyl]-2,3-dihydroinden-1-yl]piperazine-1-carboxylate Openeye Name: tert-butyl 4-[1-[(2-hydroxy-1-phenyl-ethyl)carbamoyl]indan-1-yl]piperazine-1-carboxylate CAS Name: 4-[1-[[(2-hydroxy-1-phenylethyl)amino]-oxomethyl]-2,3-dihydroinden-1-yl]-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[1-[(2-hydroxy-1-phenylethyl)carbamoyl]-2,3-dihydroinden-1-yl]piperazine-1-carboxylate Traditional Name: 4-[1-[(2-hydroxy-1-phenyl-ethyl)carbamoyl]indan-1-yl]piperazine-1-carboxylic acid tert-butyl ester Formula: C27H35N3O4 MolecularWeight: 465.5845

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCN(CC1)C2(CCC3=CC=CC=C32)C(=O)NC(CO)C4=CC=CC=C4

Isomeric SMILES

CC(C)(C)OC(=O)N1CCN(CC1)C2(CCC3=CC=CC=C32)C(=O)NC(CO)C4=CC=CC=C4

InChI

InChI=1S/C27H35N3O4/c1-26(2,3)34-25(33)29-15-17-30(18-16-29)27(14-13-20-9-7-8-12-22(20)27)24(32)28-23(19-31)21-10-5-4-6-11-21/h4-12,23,31H,13-19H2,1-3H3,(H,28,32)