3-phenylpropyl 2-[(2S)-1-(3-ethoxyphenyl)carbonyl-3-oxidanylidene-piperazin-2-yl]ethanoate

Systemtic Name: 3-phenylpropyl 2-[(2S)-1-(3-ethoxyphenyl)carbonyl-3-oxidanylidene-piperazin-2-yl]ethanoate Openeye Name: 3-phenylpropyl 2-[(2S)-1-(3-ethoxybenzoyl)-3-oxo-piperazin-2-yl]acetate CAS Name: 2-[(2S)-1-[(3-ethoxyphenyl)-oxomethyl]-3-oxo-2-piperazinyl]acetic acid 3-phenylpropyl ester IUPAC Name: 3-phenylpropyl 2-[(2S)-1-(3-ethoxybenzoyl)-3-oxopiperazin-2-yl]acetate Traditional Name: 2-[(2S)-1-(3-ethoxybenzoyl)-3-keto-piperazin-2-yl]acetic acid 3-phenylpropyl ester Formula: C24H28N2O5 MolecularWeight: 424.48952

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC(=C1)C(=O)N2CCNC(=O)C2CC(=O)OCCCC3=CC=CC=C3

Isomeric SMILES

CCOC1=CC=CC(=C1)C(=O)N2CCNC(=O)[C@@H]2CC(=O)OCCCC3=CC=CC=C3

InChI

InChI=1S/C24H28N2O5/c1-2-30-20-12-6-11-19(16-20)24(29)26-14-13-25-23(28)21(26)17-22(27)31-15-7-10-18-8-4-3-5-9-18/h3-6,8-9,11-12,16,21H,2,7,10,13-15,17H2,1H3,(H,25,28)/t21-/m0/s1