5-[3-[(3E)-2-oxidanylidene-3-(1H-pyrrol-2-ylmethylidene)-1H-indol-4-yl]prop-2-ynyl]phenanthridin-6-one

Systemtic Name: 5-[3-[(3E)-2-oxidanylidene-3-(1H-pyrrol-2-ylmethylidene)-1H-indol-4-yl]prop-2-ynyl]phenanthridin-6-one Openeye Name: 5-[3-[(3E)-2-oxo-3-(1H-pyrrol-2-ylmethylene)indolin-4-yl]prop-2-ynyl]phenanthridin-6-one CAS Name: 5-[3-[(3E)-2-oxo-3-(1H-pyrrol-2-ylmethylidene)-1H-indol-4-yl]prop-2-ynyl]-6-phenanthridinone IUPAC Name: 5-[3-[(3E)-2-oxo-3-(1H-pyrrol-2-ylmethylidene)-1H-indol-4-yl]prop-2-ynyl]phenanthridin-6-one Traditional Name: 5-[3-[(3E)-2-keto-3-(1H-pyrrol-2-ylmethylene)indolin-4-yl]prop-2-ynyl]phenanthridin-6-one Formula: C29H19N3O2 MolecularWeight: 441.48006

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C3=CC=CC=C3N(C2=O)CC#CC4=C5C(=CC=C4)NC(=O)C5=CC6=CC=CN6

Isomeric SMILES

C1=CC=C2C(=C1)C3=CC=CC=C3N(C2=O)CC#CC4=C\5C(=CC=C4)NC(=O)/C5=C/C6=CC=CN6

InChI

InChI=1S/C29H19N3O2/c33-28-24(18-20-10-6-16-30-20)27-19(8-5-14-25(27)31-28)9-7-17-32-26-15-4-3-12-22(26)21-11-1-2-13-23(21)29(32)34/h1-6,8,10-16,18,30H,17H2,(H,31,33)/b24-18+