methyl 2-[(2S)-3-oxidanylidene-1-(9H-xanthen-9-ylcarbonyl)piperazin-2-yl]ethanoate

Systemtic Name: methyl 2-[(2S)-3-oxidanylidene-1-(9H-xanthen-9-ylcarbonyl)piperazin-2-yl]ethanoate Openeye Name: methyl 2-[(2S)-3-oxo-1-(9H-xanthene-9-carbonyl)piperazin-2-yl]acetate CAS Name: 2-[(2S)-3-oxo-1-[oxo(9H-xanthen-9-yl)methyl]-2-piperazinyl]acetic acid methyl ester IUPAC Name: methyl 2-[(2S)-3-oxo-1-(9H-xanthene-9-carbonyl)piperazin-2-yl]acetate Traditional Name: 2-[(2S)-3-keto-1-(9H-xanthene-9-carbonyl)piperazin-2-yl]acetic acid methyl ester Formula: C21H20N2O5 MolecularWeight: 380.3939

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC1C(=O)NCCN1C(=O)C2C3=CC=CC=C3OC4=CC=CC=C24

Isomeric SMILES

COC(=O)C[C@H]1C(=O)NCCN1C(=O)C2C3=CC=CC=C3OC4=CC=CC=C24

InChI

InChI=1S/C21H20N2O5/c1-27-18(24)12-15-20(25)22-10-11-23(15)21(26)19-13-6-2-4-8-16(13)28-17-9-5-3-7-14(17)19/h2-9,15,19H,10-12H2,1H3,(H,22,25)/t15-/m0/s1