N-[(6-azido-2,2-dimethyl-hexyl)-(1,3-benzodioxol-5-ylsulfonyl)amino]-N-(3-oxidanyl-1-phenyl-butan-2-yl)carbamate

Systemtic Name: N-[(6-azido-2,2-dimethyl-hexyl)-(1,3-benzodioxol-5-ylsulfonyl)amino]-N-(3-oxidanyl-1-phenyl-butan-2-yl)carbamate Openeye Name: N-[(6-azido-2,2-dimethyl-hexyl)-(1,3-benzodioxol-5-ylsulfonyl)amino]-N-(1-benzyl-2-hydroxy-propyl)carbamate CAS Name: N-[(6-azido-2,2-dimethylhexyl)-(1,3-benzodioxol-5-ylsulfonyl)amino]-N-(3-hydroxy-1-phenylbutan-2-yl)carbamate IUPAC Name: N-[(6-azido-2,2-dimethylhexyl)-(1,3-benzodioxol-5-ylsulfonyl)amino]-N-(3-hydroxy-1-phenylbutan-2-yl)carbamate Traditional Name: N-[(6-azido-2,2-dimethyl-hexyl)-(1,3-benzodioxol-5-ylsulfonyl)amino]-N-(1-benzyl-2-hydroxy-propyl)carbamate Formula: C26H34N5O7S- MolecularWeight: 560.64246

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(CC1=CC=CC=C1)N(C(=O)[O-])N(CC(C)(C)CCCCN=[N+]=[N-])S(=O)(=O)C2=CC3=C(C=C2)OCO3)O

Isomeric SMILES

CC(C(CC1=CC=CC=C1)N(C(=O)[O-])N(CC(C)(C)CCCCN=[N+]=[N-])S(=O)(=O)C2=CC3=C(C=C2)OCO3)O

InChI

InChI=1S/C26H35N5O7S/c1-19(32)22(15-20-9-5-4-6-10-20)31(25(33)34)30(17-26(2,3)13-7-8-14-28-29-27)39(35,36)21-11-12-23-24(16-21)38-18-37-23/h4-6,9-12,16,19,22,32H,7-8,13-15,17-18H2,1-3H3,(H,33,34)/p-1