ethyl 3-[4-[1-(3-acetyloxypropyl)indol-3-yl]-5-cyano-2-oxidanylidene-1H-imidazol-3-yl]indole-1-carboxylate

Systemtic Name: ethyl 3-[4-[1-(3-acetyloxypropyl)indol-3-yl]-5-cyano-2-oxidanylidene-1H-imidazol-3-yl]indole-1-carboxylate Openeye Name: ethyl 3-[4-[1-(3-acetoxypropyl)indol-3-yl]-5-cyano-2-oxo-1H-imidazol-3-yl]indole-1-carboxylate CAS Name: 3-[4-[1-(3-acetyloxypropyl)-3-indolyl]-5-cyano-2-oxo-1H-imidazol-3-yl]-1-indolecarboxylic acid ethyl ester IUPAC Name: ethyl 3-[4-[1-(3-acetyloxypropyl)indol-3-yl]-5-cyano-2-oxo-1H-imidazol-3-yl]indole-1-carboxylate Traditional Name: 3-[5-[1-(3-acetoxypropyl)indol-3-yl]-4-cyano-2-keto-4-imidazolin-1-yl]indole-1-carboxylic acid ethyl ester Formula: C28H25N5O5 MolecularWeight: 511.5286

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1C=C(C2=CC=CC=C21)N3C(=C(NC3=O)C#N)C4=CN(C5=CC=CC=C54)CCCOC(=O)C

Isomeric SMILES

CCOC(=O)N1C=C(C2=CC=CC=C21)N3C(=C(NC3=O)C#N)C4=CN(C5=CC=CC=C54)CCCOC(=O)C

InChI

InChI=1S/C28H25N5O5/c1-3-37-28(36)32-17-25(20-10-5-7-12-24(20)32)33-26(22(15-29)30-27(33)35)21-16-31(13-8-14-38-18(2)34)23-11-6-4-9-19(21)23/h4-7,9-12,16-17H,3,8,13-14H2,1-2H3,(H,30,35)