butanedioic acid; tert-butyl N-(5-azanyl-4-oxidanyl-1,6-diphenyl-hexan-2-yl)carbamate

Systemtic Name: butanedioic acid; tert-butyl N-(5-azanyl-4-oxidanyl-1,6-diphenyl-hexan-2-yl)carbamate Openeye Name: tert-butyl N-(4-amino-1-benzyl-3-hydroxy-5-phenyl-pentyl)carbamate; succinic acid CAS Name: N-(5-amino-4-hydroxy-1,6-diphenylhexan-2-yl)carbamic acid tert-butyl ester; butanedioic acid IUPAC Name: butanedioic acid; tert-butyl N-(5-amino-4-hydroxy-1,6-diphenylhexan-2-yl)carbamate Traditional Name: N-(4-amino-1-benzyl-3-hydroxy-5-phenyl-pentyl)carbamic acid tert-butyl ester; succinic acid Formula: C50H70N4O10 MolecularWeight: 887.1116

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(CC1=CC=CC=C1)CC(C(CC2=CC=CC=C2)N)O.CC(C)(C)OC(=O)NC(CC1=CC=CC=C1)CC(C(CC2=CC=CC=C2)N)O.C(CC(=O)O)C(=O)O

Isomeric SMILES

CC(C)(C)OC(=O)NC(CC1=CC=CC=C1)CC(C(CC2=CC=CC=C2)N)O.CC(C)(C)OC(=O)NC(CC1=CC=CC=C1)CC(C(CC2=CC=CC=C2)N)O.C(CC(=O)O)C(=O)O

InChI

InChI=1S/2C23H32N2O3.C4H6O4/c2*1-23(2,3)28-22(27)25-19(14-17-10-6-4-7-11-17)16-21(26)20(24)15-18-12-8-5-9-13-18;5-3(6)1-2-4(7)8/h2*4-13,19-21,26H,14-16,24H2,1-3H3,(H,25,27);1-2H2,(H,5,6)(H,7,8)