5-methoxy-3-[2-[[(E)-3-(3-methoxy-4-oxidanyl-phenyl)prop-2-enoyl]amino]ethyl]-1H-indole-2-carboxylate

Systemtic Name: 5-methoxy-3-[2-[[(E)-3-(3-methoxy-4-oxidanyl-phenyl)prop-2-enoyl]amino]ethyl]-1H-indole-2-carboxylate Openeye Name: 3-[2-[[(E)-3-(4-hydroxy-3-methoxy-phenyl)prop-2-enoyl]amino]ethyl]-5-methoxy-1H-indole-2-carboxylate CAS Name: 3-[2-[[(E)-3-(4-hydroxy-3-methoxyphenyl)-1-oxoprop-2-enyl]amino]ethyl]-5-methoxy-1H-indole-2-carboxylate IUPAC Name: 3-[2-[[(E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoyl]amino]ethyl]-5-methoxy-1H-indole-2-carboxylate Traditional Name: 3-[2-[[(E)-3-(4-hydroxy-3-methoxy-phenyl)acryloyl]amino]ethyl]-5-methoxy-1H-indole-2-carboxylate Formula: C22H21N2O6- MolecularWeight: 409.41194

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)NC(=C2CCNC(=O)C=CC3=CC(=C(C=C3)O)OC)C(=O)[O-]

Isomeric SMILES

COC1=CC2=C(C=C1)NC(=C2CCNC(=O)/C=C/C3=CC(=C(C=C3)O)OC)C(=O)[O-]

InChI

InChI=1S/C22H22N2O6/c1-29-14-5-6-17-16(12-14)15(21(24-17)22(27)28)9-10-23-20(26)8-4-13-3-7-18(25)19(11-13)30-2/h3-8,11-12,24-25H,9-10H2,1-2H3,(H,23,26)(H,27,28)/p-1/b8-4+