[(1S)-2-(7-ethyl-1H-indol-3-yl)-2-oxidanylidene-1-phenyl-ethyl] 4-oxidanylidene-3H-phthalazine-1-carboxylate

Systemtic Name: [(1S)-2-(7-ethyl-1H-indol-3-yl)-2-oxidanylidene-1-phenyl-ethyl] 4-oxidanylidene-3H-phthalazine-1-carboxylate Openeye Name: [(1S)-2-(7-ethyl-1H-indol-3-yl)-2-oxo-1-phenyl-ethyl] 4-oxo-3H-phthalazine-1-carboxylate CAS Name: 4-oxo-3H-phthalazine-1-carboxylic acid [(1S)-2-(7-ethyl-1H-indol-3-yl)-2-oxo-1-phenylethyl] ester IUPAC Name: [(1S)-2-(7-ethyl-1H-indol-3-yl)-2-oxo-1-phenylethyl] 4-oxo-3H-phthalazine-1-carboxylate Traditional Name: 4-keto-3H-phthalazine-1-carboxylic acid [(1S)-2-(7-ethyl-1H-indol-3-yl)-2-keto-1-phenyl-ethyl] ester Formula: C27H21N3O4 MolecularWeight: 451.47334

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC2=C1NC=C2C(=O)C(C3=CC=CC=C3)OC(=O)C4=NNC(=O)C5=CC=CC=C54

Isomeric SMILES

CCC1=CC=CC2=C1NC=C2C(=O)[C@H](C3=CC=CC=C3)OC(=O)C4=NNC(=O)C5=CC=CC=C54

InChI

InChI=1S/C27H21N3O4/c1-2-16-11-8-14-19-21(15-28-22(16)19)24(31)25(17-9-4-3-5-10-17)34-27(33)23-18-12-6-7-13-20(18)26(32)30-29-23/h3-15,25,28H,2H2,1H3,(H,30,32)/t25-/m0/s1