5-[5-(2,2-dimethyl-4-oxidanylidene-1,3,5,6-tetrahydrobenzo[a]phenanthridin-5-yl)furan-2-yl]-2-oxidanyl-benzoic acid

Systemtic Name: 5-[5-(2,2-dimethyl-4-oxidanylidene-1,3,5,6-tetrahydrobenzo[a]phenanthridin-5-yl)furan-2-yl]-2-oxidanyl-benzoic acid Openeye Name: 5-[5-(2,2-dimethyl-4-oxo-1,3,5,6-tetrahydrobenzo[a]phenanthridin-5-yl)-2-furyl]-2-hydroxy-benzoic acid CAS Name: 5-[5-(2,2-dimethyl-4-oxo-1,3,5,6-tetrahydrobenzo[a]phenanthridin-5-yl)-2-furanyl]-2-hydroxybenzoic acid IUPAC Name: 5-[5-(2,2-dimethyl-4-oxo-1,3,5,6-tetrahydrobenzo[a]phenanthridin-5-yl)furan-2-yl]-2-hydroxybenzoic acid Traditional Name: 2-hydroxy-5-[5-(4-keto-2,2-dimethyl-1,3,5,6-tetrahydrobenzo[a]phenanthridin-5-yl)-2-furyl]benzoic acid Formula: C30H25NO5 MolecularWeight: 479.5232

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2=C(C(NC3=C2C4=CC=CC=C4C=C3)C5=CC=C(O5)C6=CC(=C(C=C6)O)C(=O)O)C(=O)C1)C

Isomeric SMILES

CC1(CC2=C(C(NC3=C2C4=CC=CC=C4C=C3)C5=CC=C(O5)C6=CC(=C(C=C6)O)C(=O)O)C(=O)C1)C

InChI

InChI=1S/C30H25NO5/c1-30(2)14-20-26-18-6-4-3-5-16(18)7-9-21(26)31-28(27(20)23(33)15-30)25-12-11-24(36-25)17-8-10-22(32)19(13-17)29(34)35/h3-13,28,31-32H,14-15H2,1-2H3,(H,34,35)