tert-butyl 4-[(1R,2S)-2-[(4-methoxyphenyl)carbamoylamino]-1,2-diphenyl-ethyl]piperazine-1-carboxylate

Systemtic Name: tert-butyl 4-[(1R,2S)-2-[(4-methoxyphenyl)carbamoylamino]-1,2-diphenyl-ethyl]piperazine-1-carboxylate Openeye Name: tert-butyl 4-[(1R,2S)-2-[(4-methoxyphenyl)carbamoylamino]-1,2-diphenyl-ethyl]piperazine-1-carboxylate CAS Name: 4-[(1R,2S)-2-[[(4-methoxyanilino)-oxomethyl]amino]-1,2-diphenylethyl]-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[(1R,2S)-2-[(4-methoxyphenyl)carbamoylamino]-1,2-diphenylethyl]piperazine-1-carboxylate Traditional Name: 4-[(1R,2S)-2-[(4-methoxyphenyl)carbamoylamino]-1,2-diphenyl-ethyl]piperazine-1-carboxylic acid tert-butyl ester Formula: C31H38N4O4 MolecularWeight: 530.65782

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCN(CC1)C(C2=CC=CC=C2)C(C3=CC=CC=C3)NC(=O)NC4=CC=C(C=C4)OC

Isomeric SMILES

CC(C)(C)OC(=O)N1CCN(CC1)[C@H](C2=CC=CC=C2)[C@H](C3=CC=CC=C3)NC(=O)NC4=CC=C(C=C4)OC

InChI

InChI=1S/C31H38N4O4/c1-31(2,3)39-30(37)35-21-19-34(20-22-35)28(24-13-9-6-10-14-24)27(23-11-7-5-8-12-23)33-29(36)32-25-15-17-26(38-4)18-16-25/h5-18,27-28H,19-22H2,1-4H3,(H2,32,33,36)/t27-,28+/m0/s1