2-[(E)-1-oxidanyl-3-(phenethylamino)prop-2-enylidene]cyclopentane-1,3-dione

Systemtic Name: 2-[(E)-1-oxidanyl-3-(phenethylamino)prop-2-enylidene]cyclopentane-1,3-dione Openeye Name: 2-[(E)-1-hydroxy-3-(phenethylamino)prop-2-enylidene]cyclopentane-1,3-dione CAS Name: 2-[(E)-1-hydroxy-3-(phenethylamino)prop-2-enylidene]cyclopentane-1,3-dione IUPAC Name: 2-[(E)-1-hydroxy-3-(phenethylamino)prop-2-enylidene]cyclopentane-1,3-dione Traditional Name: 2-[(E)-1-hydroxy-3-(phenethylamino)prop-2-enylidene]cyclopentane-1,3-quinone Formula: C16H17NO3 MolecularWeight: 271.31108

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)C(=C(C=CNCCC2=CC=CC=C2)O)C1=O

Isomeric SMILES

C1CC(=O)C(=C(/C=C/NCCC2=CC=CC=C2)O)C1=O

InChI

InChI=1S/C16H17NO3/c18-13-6-7-14(19)16(13)15(20)9-11-17-10-8-12-4-2-1-3-5-12/h1-5,9,11,17,20H,6-8,10H2/b11-9+