(phenylmethyl) 2-[9H-fluoren-9-ylmethoxycarbonyl-(4-methoxyphenyl)amino]ethanoate hydrochloride

Systemtic Name: (phenylmethyl) 2-[9H-fluoren-9-ylmethoxycarbonyl-(4-methoxyphenyl)amino]ethanoate hydrochloride Openeye Name: benzyl 2-[N-(9H-fluoren-9-ylmethoxycarbonyl)-4-methoxy-anilino]acetate hydrochloride CAS Name: 2-(N-[9H-fluoren-9-ylmethoxy(oxo)methyl]-4-methoxyanilino)acetic acid (phenylmethyl) ester hydrochloride IUPAC Name: benzyl 2-[N-(9H-fluoren-9-ylmethoxycarbonyl)-4-methoxyanilino]acetate hydrochloride Traditional Name: 2-[N-(9H-fluoren-9-ylmethoxycarbonyl)-4-methoxy-anilino]acetic acid benzyl ester hydrochloride Formula: C31H28ClNO5 MolecularWeight: 530.01072

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N(CC(=O)OCC2=CC=CC=C2)C(=O)OCC3C4=CC=CC=C4C5=CC=CC=C35.Cl

Isomeric SMILES

COC1=CC=C(C=C1)N(CC(=O)OCC2=CC=CC=C2)C(=O)OCC3C4=CC=CC=C4C5=CC=CC=C35.Cl

InChI

InChI=1S/C31H27NO5.ClH/c1-35-24-17-15-23(16-18-24)32(19-30(33)36-20-22-9-3-2-4-10-22)31(34)37-21-29-27-13-7-5-11-25(27)26-12-6-8-14-28(26)29;/h2-18,29H,19-21H2,1H3;1H