tert-butyl N-[5-[(3-azanyl-2-methyl-phenyl)carbonylamino]-4-oxidanyl-1,6-diphenyl-hexan-2-yl]carbamate

Systemtic Name: tert-butyl N-[5-[(3-azanyl-2-methyl-phenyl)carbonylamino]-4-oxidanyl-1,6-diphenyl-hexan-2-yl]carbamate Openeye Name: tert-butyl N-[4-[(3-amino-2-methyl-benzoyl)amino]-1-benzyl-3-hydroxy-5-phenyl-pentyl]carbamate CAS Name: N-[5-[[(3-amino-2-methylphenyl)-oxomethyl]amino]-4-hydroxy-1,6-diphenylhexan-2-yl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[5-[(3-amino-2-methylbenzoyl)amino]-4-hydroxy-1,6-diphenylhexan-2-yl]carbamate Traditional Name: N-[4-[(3-amino-2-methyl-benzoyl)amino]-1-benzyl-3-hydroxy-5-phenyl-pentyl]carbamic acid tert-butyl ester Formula: C31H39N3O4 MolecularWeight: 517.65906

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1N)C(=O)NC(CC2=CC=CC=C2)C(CC(CC3=CC=CC=C3)NC(=O)OC(C)(C)C)O

Isomeric SMILES

CC1=C(C=CC=C1N)C(=O)NC(CC2=CC=CC=C2)C(CC(CC3=CC=CC=C3)NC(=O)OC(C)(C)C)O

InChI

InChI=1S/C31H39N3O4/c1-21-25(16-11-17-26(21)32)29(36)34-27(19-23-14-9-6-10-15-23)28(35)20-24(18-22-12-7-5-8-13-22)33-30(37)38-31(2,3)4/h5-17,24,27-28,35H,18-20,32H2,1-4H3,(H,33,37)(H,34,36)