ethyl 2-[(3R)-4-[(2R)-2-[[(2S)-2-azanyl-3-(4-hydroxyphenyl)propanoyl]amino]propanoyl]-2-oxidanylidene-3-(phenylmethyl)piperazin-1-yl]ethanoate

Systemtic Name: ethyl 2-[(3R)-4-[(2R)-2-[[(2S)-2-azanyl-3-(4-hydroxyphenyl)propanoyl]amino]propanoyl]-2-oxidanylidene-3-(phenylmethyl)piperazin-1-yl]ethanoate Openeye Name: ethyl 2-[(3R)-4-[(2R)-2-[[(2S)-2-amino-3-(4-hydroxyphenyl)propanoyl]amino]propanoyl]-3-benzyl-2-oxo-piperazin-1-yl]acetate CAS Name: 2-[(3R)-4-[(2R)-2-[[(2S)-2-amino-3-(4-hydroxyphenyl)-1-oxopropyl]amino]-1-oxopropyl]-2-oxo-3-(phenylmethyl)-1-piperazinyl]acetic acid ethyl ester IUPAC Name: ethyl 2-[(3R)-4-[(2R)-2-[[(2S)-2-amino-3-(4-hydroxyphenyl)propanoyl]amino]propanoyl]-3-benzyl-2-oxopiperazin-1-yl]acetate Traditional Name: 2-[(3R)-4-[(2R)-2-[[(2S)-2-amino-3-(4-hydroxyphenyl)propanoyl]amino]propanoyl]-3-benzyl-2-keto-piperazino]acetic acid ethyl ester Formula: C27H34N4O6 MolecularWeight: 510.58206

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CN1CCN(C(C1=O)CC2=CC=CC=C2)C(=O)C(C)NC(=O)C(CC3=CC=C(C=C3)O)N

Isomeric SMILES

CCOC(=O)CN1CCN([C@@H](C1=O)CC2=CC=CC=C2)C(=O)[C@@H](C)NC(=O)[C@H](CC3=CC=C(C=C3)O)N

InChI

InChI=1S/C27H34N4O6/c1-3-37-24(33)17-30-13-14-31(23(27(30)36)16-19-7-5-4-6-8-19)26(35)18(2)29-25(34)22(28)15-20-9-11-21(32)12-10-20/h4-12,18,22-23,32H,3,13-17,28H2,1-2H3,(H,29,34)/t18-,22+,23-/m1/s1