2-[3,5-bis[(3-ethynylphenyl)carbamoyl]phenyl]-3-oxidanylidene-inden-1-olate

Systemtic Name: 2-[3,5-bis[(3-ethynylphenyl)carbamoyl]phenyl]-3-oxidanylidene-inden-1-olate Openeye Name: 2-[3,5-bis[(3-ethynylphenyl)carbamoyl]phenyl]-3-oxo-inden-1-olate CAS Name: 2-[3,5-bis[(3-ethynylanilino)-oxomethyl]phenyl]-3-oxo-1-indenolate IUPAC Name: 2-[3,5-bis[(3-ethynylphenyl)carbamoyl]phenyl]-3-oxoinden-1-olate Traditional Name: 2-[3,5-bis[(3-ethynylphenyl)carbamoyl]phenyl]-3-keto-inden-1-olate Formula: C33H19N2O4- MolecularWeight: 507.51496

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Descriptors Computed from Structure

Canonical SMILES:

C#CC1=CC(=CC=C1)NC(=O)C2=CC(=CC(=C2)C3=C(C4=CC=CC=C4C3=O)[O-])C(=O)NC5=CC=CC(=C5)C#C

Isomeric SMILES

C#CC1=CC(=CC=C1)NC(=O)C2=CC(=CC(=C2)C3=C(C4=CC=CC=C4C3=O)[O-])C(=O)NC5=CC=CC(=C5)C#C

InChI

InChI=1S/C33H20N2O4/c1-3-20-9-7-11-25(15-20)34-32(38)23-17-22(29-30(36)27-13-5-6-14-28(27)31(29)37)18-24(19-23)33(39)35-26-12-8-10-21(4-2)16-26/h1-2,5-19,36H,(H,34,38)(H,35,39)/p-1