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

Systemtic Name: 2-[1,3-benzodioxol-5-ylmethyl-(4-methoxy-2,3,6-trimethyl-phenyl)sulfonyl-amino]-3-oxidanyl-N-phenylmethoxy-butanamide Openeye Name: 2-[1,3-benzodioxol-5-ylmethyl-(4-methoxy-2,3,6-trimethyl-phenyl)sulfonyl-amino]-N-benzyloxy-3-hydroxy-butanamide CAS Name: 2-[1,3-benzodioxol-5-ylmethyl-(4-methoxy-2,3,6-trimethylphenyl)sulfonylamino]-3-hydroxy-N-phenylmethoxybutanamide IUPAC Name: 2-[1,3-benzodioxol-5-ylmethyl-(4-methoxy-2,3,6-trimethylphenyl)sulfonylamino]-3-hydroxy-N-phenylmethoxybutanamide Traditional Name: N-benzoxy-3-hydroxy-2-[(4-methoxy-2,3,6-trimethyl-phenyl)sulfonyl-piperonyl-amino]butyramide Formula: C29H34N2O8S MolecularWeight: 570.65386

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C29H34N2O8S/c1-18-13-25(36-5)19(2)20(3)28(18)40(34,35)31(15-23-11-12-24-26(14-23)38-17-37-24)27(21(4)32)29(33)30-39-16-22-9-7-6-8-10-22/h6-14,21,27,32H,15-17H2,1-5H3,(H,30,33)