N-[(1R)-2-(1,3-benzodioxol-5-ylamino)-2-oxidanylidene-1-phenyl-ethyl]-3-(3,5-ditert-butyl-4-oxidanyl-phenyl)propanamide

Systemtic Name: N-[(1R)-2-(1,3-benzodioxol-5-ylamino)-2-oxidanylidene-1-phenyl-ethyl]-3-(3,5-ditert-butyl-4-oxidanyl-phenyl)propanamide Openeye Name: N-[(1R)-2-(1,3-benzodioxol-5-ylamino)-2-oxo-1-phenyl-ethyl]-3-(3,5-ditert-butyl-4-hydroxy-phenyl)propanamide CAS Name: N-[(1R)-2-(1,3-benzodioxol-5-ylamino)-2-oxo-1-phenylethyl]-3-(3,5-ditert-butyl-4-hydroxyphenyl)propanamide IUPAC Name: N-[(1R)-2-(1,3-benzodioxol-5-ylamino)-2-oxo-1-phenylethyl]-3-(3,5-ditert-butyl-4-hydroxyphenyl)propanamide Traditional Name: N-[(1R)-2-(1,3-benzodioxol-5-ylamino)-2-keto-1-phenyl-ethyl]-3-(3,5-ditert-butyl-4-hydroxy-phenyl)propionamide Formula: C32H38N2O5 MolecularWeight: 530.65452

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)CCC(=O)NC(C2=CC=CC=C2)C(=O)NC3=CC4=C(C=C3)OCO4

Isomeric SMILES

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)CCC(=O)N[C@H](C2=CC=CC=C2)C(=O)NC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C32H38N2O5/c1-31(2,3)23-16-20(17-24(29(23)36)32(4,5)6)12-15-27(35)34-28(21-10-8-7-9-11-21)30(37)33-22-13-14-25-26(18-22)39-19-38-25/h7-11,13-14,16-18,28,36H,12,15,19H2,1-6H3,(H,33,37)(H,34,35)/t28-/m1/s1