propyl 2-[(2S)-3-oxidanylidene-1-(2-pentoxyphenyl)carbonyl-piperazin-2-yl]ethanoate

Systemtic Name: propyl 2-[(2S)-3-oxidanylidene-1-(2-pentoxyphenyl)carbonyl-piperazin-2-yl]ethanoate Openeye Name: propyl 2-[(2S)-3-oxo-1-(2-pentoxybenzoyl)piperazin-2-yl]acetate CAS Name: 2-[(2S)-3-oxo-1-[oxo-(2-pentoxyphenyl)methyl]-2-piperazinyl]acetic acid propyl ester IUPAC Name: propyl 2-[(2S)-3-oxo-1-(2-pentoxybenzoyl)piperazin-2-yl]acetate Traditional Name: 2-[(2S)-1-(2-amoxybenzoyl)-3-keto-piperazin-2-yl]acetic acid propyl ester Formula: C21H30N2O5 MolecularWeight: 390.4733

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=CC=CC=C1C(=O)N2CCNC(=O)C2CC(=O)OCCC

Isomeric SMILES

CCCCCOC1=CC=CC=C1C(=O)N2CCNC(=O)[C@@H]2CC(=O)OCCC

InChI

InChI=1S/C21H30N2O5/c1-3-5-8-14-27-18-10-7-6-9-16(18)21(26)23-12-11-22-20(25)17(23)15-19(24)28-13-4-2/h6-7,9-10,17H,3-5,8,11-15H2,1-2H3,(H,22,25)/t17-/m0/s1