phenacyl 4-(1H-indol-6-ylamino)-4-oxidanylidene-butanoate

Systemtic Name: phenacyl 4-(1H-indol-6-ylamino)-4-oxidanylidene-butanoate Openeye Name: phenacyl 4-(1H-indol-6-ylamino)-4-oxo-butanoate CAS Name: 4-(1H-indol-6-ylamino)-4-oxobutanoic acid phenacyl ester IUPAC Name: phenacyl 4-(1H-indol-6-ylamino)-4-oxobutanoate Traditional Name: 4-(1H-indol-6-ylamino)-4-keto-butyric acid phenacyl ester Formula: C20H18N2O4 MolecularWeight: 350.36792

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)COC(=O)CCC(=O)NC2=CC3=C(C=C2)C=CN3

Isomeric SMILES

C1=CC=C(C=C1)C(=O)COC(=O)CCC(=O)NC2=CC3=C(C=C2)C=CN3

InChI

InChI=1S/C20H18N2O4/c23-18(15-4-2-1-3-5-15)13-26-20(25)9-8-19(24)22-16-7-6-14-10-11-21-17(14)12-16/h1-7,10-12,21H,8-9,13H2,(H,22,24)