2-[3-[(E)-2-cyano-3-[(2-methoxydibenzofuran-3-yl)amino]-3-oxidanylidene-prop-1-enyl]indol-1-yl]ethanoic acid

Systemtic Name: 2-[3-[(E)-2-cyano-3-[(2-methoxydibenzofuran-3-yl)amino]-3-oxidanylidene-prop-1-enyl]indol-1-yl]ethanoic acid Openeye Name: 2-[3-[(E)-2-cyano-3-[(2-methoxydibenzofuran-3-yl)amino]-3-oxo-prop-1-enyl]indol-1-yl]acetic acid CAS Name: 2-[3-[(E)-2-cyano-3-[(2-methoxy-3-dibenzofuranyl)amino]-3-oxoprop-1-enyl]-1-indolyl]acetic acid IUPAC Name: 2-[3-[(E)-2-cyano-3-[(2-methoxydibenzofuran-3-yl)amino]-3-oxoprop-1-enyl]indol-1-yl]acetic acid Traditional Name: 2-[3-[(E)-2-cyano-3-keto-3-[(2-methoxydibenzofuran-3-yl)amino]prop-1-enyl]indol-1-yl]acetic acid Formula: C27H19N3O5 MolecularWeight: 465.45686

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C3=CC=CC=C3O2)NC(=O)C(=CC4=CN(C5=CC=CC=C54)CC(=O)O)C#N

Isomeric SMILES

COC1=C(C=C2C(=C1)C3=CC=CC=C3O2)NC(=O)/C(=C/C4=CN(C5=CC=CC=C54)CC(=O)O)/C#N

InChI

InChI=1S/C27H19N3O5/c1-34-25-11-20-19-7-3-5-9-23(19)35-24(20)12-21(25)29-27(33)16(13-28)10-17-14-30(15-26(31)32)22-8-4-2-6-18(17)22/h2-12,14H,15H2,1H3,(H,29,33)(H,31,32)/b16-10+