(phenylmethyl) (3S)-4-azanyl-3-(9H-fluoren-9-ylmethoxycarbonylamino)butanoate hydrochloride

Systemtic Name: (phenylmethyl) (3S)-4-azanyl-3-(9H-fluoren-9-ylmethoxycarbonylamino)butanoate hydrochloride Openeye Name: benzyl (3S)-4-amino-3-(9H-fluoren-9-ylmethoxycarbonylamino)butanoate hydrochloride CAS Name: (3S)-4-amino-3-[[9H-fluoren-9-ylmethoxy(oxo)methyl]amino]butanoic acid (phenylmethyl) ester hydrochloride IUPAC Name: benzyl (3S)-4-amino-3-(9H-fluoren-9-ylmethoxycarbonylamino)butanoate hydrochloride Traditional Name: (3S)-4-amino-3-(9H-fluoren-9-ylmethoxycarbonylamino)butyric acid benzyl ester hydrochloride Formula: C26H27ClN2O4 MolecularWeight: 466.95658

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)CC(CN)NC(=O)OCC2C3=CC=CC=C3C4=CC=CC=C24.Cl

Isomeric SMILES

C1=CC=C(C=C1)COC(=O)C[C@@H](CN)NC(=O)OCC2C3=CC=CC=C3C4=CC=CC=C24.Cl

InChI

InChI=1S/C26H26N2O4.ClH/c27-15-19(14-25(29)31-16-18-8-2-1-3-9-18)28-26(30)32-17-24-22-12-6-4-10-20(22)21-11-5-7-13-23(21)24;/h1-13,19,24H,14-17,27H2,(H,28,30);1H/t19-;/m0./s1