4-[[6-(2-ethylhexanoylamino)-3-[(E)-3-methoxy-3-oxidanylidene-prop-1-enyl]indol-1-yl]methyl]-3-methoxy-benzoic acid

Systemtic Name: 4-[[6-(2-ethylhexanoylamino)-3-[(E)-3-methoxy-3-oxidanylidene-prop-1-enyl]indol-1-yl]methyl]-3-methoxy-benzoic acid Openeye Name: 4-[[6-(2-ethylhexanoylamino)-3-[(E)-3-methoxy-3-oxo-prop-1-enyl]indol-1-yl]methyl]-3-methoxy-benzoic acid CAS Name: 4-[[6-[(2-ethyl-1-oxohexyl)amino]-3-[(E)-3-methoxy-3-oxoprop-1-enyl]-1-indolyl]methyl]-3-methoxybenzoic acid IUPAC Name: 4-[[6-(2-ethylhexanoylamino)-3-[(E)-3-methoxy-3-oxoprop-1-enyl]indol-1-yl]methyl]-3-methoxybenzoic acid Traditional Name: 4-[[6-(2-ethylhexanoylamino)-3-[(E)-3-keto-3-methoxy-prop-1-enyl]indol-1-yl]methyl]-3-methoxy-benzoic acid Formula: C29H34N2O6 MolecularWeight: 506.59006

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)C(=O)NC1=CC2=C(C=C1)C(=CN2CC3=C(C=C(C=C3)C(=O)O)OC)C=CC(=O)OC

Isomeric SMILES

CCCCC(CC)C(=O)NC1=CC2=C(C=C1)C(=CN2CC3=C(C=C(C=C3)C(=O)O)OC)/C=C/C(=O)OC

InChI

InChI=1S/C29H34N2O6/c1-5-7-8-19(6-2)28(33)30-23-12-13-24-21(11-14-27(32)37-4)17-31(25(24)16-23)18-22-10-9-20(29(34)35)15-26(22)36-3/h9-17,19H,5-8,18H2,1-4H3,(H,30,33)(H,34,35)/b14-11+