(2E)-5,5-dimethyl-2-(phenylmethoxycarbonylamino)hepta-2,6-dienoic acid

Systemtic Name: (2E)-5,5-dimethyl-2-(phenylmethoxycarbonylamino)hepta-2,6-dienoic acid Openeye Name: (2E)-2-(benzyloxycarbonylamino)-5,5-dimethyl-hepta-2,6-dienoic acid CAS Name: (2E)-5,5-dimethyl-2-(phenylmethoxycarbonylamino)hepta-2,6-dienoic acid IUPAC Name: (2E)-5,5-dimethyl-2-(phenylmethoxycarbonylamino)hepta-2,6-dienoic acid Traditional Name: (2E)-2-(benzyloxycarbonylamino)-5,5-dimethyl-hepta-2,6-dienoic acid Formula: C17H21NO4 MolecularWeight: 303.35294

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CC=C(C(=O)O)NC(=O)OCC1=CC=CC=C1)C=C

Isomeric SMILES

CC(C)(C/C=C(\C(=O)O)/NC(=O)OCC1=CC=CC=C1)C=C

InChI

InChI=1S/C17H21NO4/c1-4-17(2,3)11-10-14(15(19)20)18-16(21)22-12-13-8-6-5-7-9-13/h4-10H,1,11-12H2,2-3H3,(H,18,21)(H,19,20)/b14-10+