4-methoxy-5-[(2-oxidanyl-3-phenyl-propyl)amino]cyclohexa-3,5-diene-1,2-dione

Systemtic Name: 4-methoxy-5-[(2-oxidanyl-3-phenyl-propyl)amino]cyclohexa-3,5-diene-1,2-dione Openeye Name: 4-[(2-hydroxy-3-phenyl-propyl)amino]-5-methoxy-1,2-benzoquinone CAS Name: 4-[(2-hydroxy-3-phenylpropyl)amino]-5-methoxycyclohexa-3,5-diene-1,2-dione IUPAC Name: 4-[(2-hydroxy-3-phenylpropyl)amino]-5-methoxycyclohexa-3,5-diene-1,2-dione Traditional Name: 4-[(2-hydroxy-3-phenyl-propyl)amino]-5-methoxy-o-benzoquinone Formula: C16H17NO4 MolecularWeight: 287.31048

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=O)C(=O)C=C1NCC(CC2=CC=CC=C2)O

Isomeric SMILES

COC1=CC(=O)C(=O)C=C1NCC(CC2=CC=CC=C2)O

InChI

InChI=1S/C16H17NO4/c1-21-16-9-15(20)14(19)8-13(16)17-10-12(18)7-11-5-3-2-4-6-11/h2-6,8-9,12,17-18H,7,10H2,1H3