ethyl 2-[phenylmethoxycarbonylamino-[(2S)-2-(propan-2-ylcarbamoyl)pyrrolidin-1-yl]carbonyl-amino]ethanoate

Systemtic Name: ethyl 2-[phenylmethoxycarbonylamino-[(2S)-2-(propan-2-ylcarbamoyl)pyrrolidin-1-yl]carbonyl-amino]ethanoate Openeye Name: ethyl 2-[benzyloxycarbonylamino-[(2S)-2-(isopropylcarbamoyl)pyrrolidine-1-carbonyl]amino]acetate CAS Name: 2-[[oxo-[(2S)-2-[oxo-(propan-2-ylamino)methyl]-1-pyrrolidinyl]methyl]-(phenylmethoxycarbonylamino)amino]acetic acid ethyl ester IUPAC Name: ethyl 2-[phenylmethoxycarbonylamino-[(2S)-2-(propan-2-ylcarbamoyl)pyrrolidine-1-carbonyl]amino]acetate Traditional Name: 2-[benzyloxycarbonylamino-[(2S)-2-(isopropylcarbamoyl)pyrrolidine-1-carbonyl]amino]acetic acid ethyl ester Formula: C21H30N4O6 MolecularWeight: 434.4861

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CN(C(=O)N1CCCC1C(=O)NC(C)C)NC(=O)OCC2=CC=CC=C2

Isomeric SMILES

CCOC(=O)CN(C(=O)N1CCC[C@H]1C(=O)NC(C)C)NC(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C21H30N4O6/c1-4-30-18(26)13-25(23-20(28)31-14-16-9-6-5-7-10-16)21(29)24-12-8-11-17(24)19(27)22-15(2)3/h5-7,9-10,15,17H,4,8,11-14H2,1-3H3,(H,22,27)(H,23,28)/t17-/m0/s1