2-[1,3-benzodioxol-5-ylmethyl-(4-methoxy-2,6-dimethyl-phenyl)sulfonyl-amino]-3-oxidanyl-N-phenylmethoxy-propanamide

Systemtic Name: 2-[1,3-benzodioxol-5-ylmethyl-(4-methoxy-2,6-dimethyl-phenyl)sulfonyl-amino]-3-oxidanyl-N-phenylmethoxy-propanamide Openeye Name: 2-[1,3-benzodioxol-5-ylmethyl-(4-methoxy-2,6-dimethyl-phenyl)sulfonyl-amino]-N-benzyloxy-3-hydroxy-propanamide CAS Name: 2-[1,3-benzodioxol-5-ylmethyl-(4-methoxy-2,6-dimethylphenyl)sulfonylamino]-3-hydroxy-N-phenylmethoxypropanamide IUPAC Name: 2-[1,3-benzodioxol-5-ylmethyl-(4-methoxy-2,6-dimethylphenyl)sulfonylamino]-3-hydroxy-N-phenylmethoxypropanamide Traditional Name: N-benzoxy-3-hydroxy-2-[(4-methoxy-2,6-dimethyl-phenyl)sulfonyl-piperonyl-amino]propionamide Formula: C27H30N2O8S MolecularWeight: 542.6007

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1S(=O)(=O)N(CC2=CC3=C(C=C2)OCO3)C(CO)C(=O)NOCC4=CC=CC=C4)C)OC

Isomeric SMILES

CC1=CC(=CC(=C1S(=O)(=O)N(CC2=CC3=C(C=C2)OCO3)C(CO)C(=O)NOCC4=CC=CC=C4)C)OC

InChI

InChI=1S/C27H30N2O8S/c1-18-11-22(34-3)12-19(2)26(18)38(32,33)29(14-21-9-10-24-25(13-21)36-17-35-24)23(15-30)27(31)28-37-16-20-7-5-4-6-8-20/h4-13,23,30H,14-17H2,1-3H3,(H,28,31)