tert-butyl 4-[1-[1-(3,5-dimethylphenyl)ethylcarbamoyl]-2,3-dihydroinden-1-yl]piperazine-1-carboxylate

Systemtic Name: tert-butyl 4-[1-[1-(3,5-dimethylphenyl)ethylcarbamoyl]-2,3-dihydroinden-1-yl]piperazine-1-carboxylate Openeye Name: tert-butyl 4-[1-[1-(3,5-dimethylphenyl)ethylcarbamoyl]indan-1-yl]piperazine-1-carboxylate CAS Name: 4-[1-[[1-(3,5-dimethylphenyl)ethylamino]-oxomethyl]-2,3-dihydroinden-1-yl]-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[1-[1-(3,5-dimethylphenyl)ethylcarbamoyl]-2,3-dihydroinden-1-yl]piperazine-1-carboxylate Traditional Name: 4-[1-[1-(3,5-dimethylphenyl)ethylcarbamoyl]indan-1-yl]piperazine-1-carboxylic acid tert-butyl ester Formula: C29H39N3O3 MolecularWeight: 477.63826

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)C(C)NC(=O)C2(CCC3=CC=CC=C32)N4CCN(CC4)C(=O)OC(C)(C)C)C

Isomeric SMILES

CC1=CC(=CC(=C1)C(C)NC(=O)C2(CCC3=CC=CC=C32)N4CCN(CC4)C(=O)OC(C)(C)C)C

InChI

InChI=1S/C29H39N3O3/c1-20-17-21(2)19-24(18-20)22(3)30-26(33)29(12-11-23-9-7-8-10-25(23)29)32-15-13-31(14-16-32)27(34)35-28(4,5)6/h7-10,17-19,22H,11-16H2,1-6H3,(H,30,33)