2-azanyl-2-[6,7-bis[(4-methylphenyl)carbonyloxy]naphthalen-1-yl]propanoic acid hydrochloride

Systemtic Name: 2-azanyl-2-[6,7-bis[(4-methylphenyl)carbonyloxy]naphthalen-1-yl]propanoic acid hydrochloride Openeye Name: 2-amino-2-[6,7-bis[(4-methylbenzoyl)oxy]-1-naphthyl]propanoic acid hydrochloride CAS Name: 2-amino-2-[6,7-bis[(4-methylphenyl)-oxomethoxy]-1-naphthalenyl]propanoic acid hydrochloride IUPAC Name: 2-amino-2-[6,7-bis[(4-methylbenzoyl)oxy]naphthalen-1-yl]propanoic acid hydrochloride Traditional Name: 2-amino-2-[6,7-bis(p-toluoyloxy)-1-naphthyl]propionic acid hydrochloride Formula: C29H26ClNO6 MolecularWeight: 519.97284

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)OC2=C(C=C3C(=C2)C=CC=C3C(C)(C(=O)O)N)OC(=O)C4=CC=C(C=C4)C.Cl

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)OC2=C(C=C3C(=C2)C=CC=C3C(C)(C(=O)O)N)OC(=O)C4=CC=C(C=C4)C.Cl

InChI

InChI=1S/C29H25NO6.ClH/c1-17-7-11-19(12-8-17)26(31)35-24-15-21-5-4-6-23(29(3,30)28(33)34)22(21)16-25(24)36-27(32)20-13-9-18(2)10-14-20;/h4-16H,30H2,1-3H3,(H,33,34);1H