4-[(E)-3-methyl-3,4-bis(oxidanyl)but-1-enyl]-1H-indole-3-carbaldehyde

Systemtic Name: 4-[(E)-3-methyl-3,4-bis(oxidanyl)but-1-enyl]-1H-indole-3-carbaldehyde Openeye Name: 4-[(E)-3,4-dihydroxy-3-methyl-but-1-enyl]-1H-indole-3-carbaldehyde CAS Name: 4-[(E)-3,4-dihydroxy-3-methylbut-1-enyl]-1H-indole-3-carboxaldehyde IUPAC Name: 4-[(E)-3,4-dihydroxy-3-methylbut-1-enyl]-1H-indole-3-carbaldehyde Traditional Name: 4-[(E)-3,4-dihydroxy-3-methyl-but-1-enyl]-1H-indole-3-carbaldehyde Formula: C14H15NO3 MolecularWeight: 245.2738

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Descriptors Computed from Structure

Canonical SMILES:

CC(CO)(C=CC1=C2C(=CC=C1)NC=C2C=O)O

Isomeric SMILES

CC(CO)(/C=C/C1=C2C(=CC=C1)NC=C2C=O)O

InChI

InChI=1S/C14H15NO3/c1-14(18,9-17)6-5-10-3-2-4-12-13(10)11(8-16)7-15-12/h2-8,15,17-18H,9H2,1H3/b6-5+