[2-tert-butyl-6-[[2-cyclohexylethyl(phenyl)carbamoyl]amino]-4-methoxy-phenyl] 2-azanylethanoate hydrochloride

Systemtic Name: [2-tert-butyl-6-[[2-cyclohexylethyl(phenyl)carbamoyl]amino]-4-methoxy-phenyl] 2-azanylethanoate hydrochloride Openeye Name: [2-tert-butyl-6-[[2-cyclohexylethyl(phenyl)carbamoyl]amino]-4-methoxy-phenyl] 2-aminoacetate hydrochloride CAS Name: 2-aminoacetic acid [2-tert-butyl-6-[[[N-(2-cyclohexylethyl)anilino]-oxomethyl]amino]-4-methoxyphenyl] ester hydrochloride IUPAC Name: [2-tert-butyl-6-[[2-cyclohexylethyl(phenyl)carbamoyl]amino]-4-methoxyphenyl] 2-aminoacetate hydrochloride Traditional Name: 2-aminoacetic acid [2-tert-butyl-6-[[2-cyclohexylethyl(phenyl)carbamoyl]amino]-4-methoxy-phenyl] ester hydrochloride Formula: C28H40ClN3O4 MolecularWeight: 518.0879

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=CC(=C1OC(=O)CN)NC(=O)N(CCC2CCCCC2)C3=CC=CC=C3)OC.Cl

Isomeric SMILES

CC(C)(C)C1=CC(=CC(=C1OC(=O)CN)NC(=O)N(CCC2CCCCC2)C3=CC=CC=C3)OC.Cl

InChI

InChI=1S/C28H39N3O4.ClH/c1-28(2,3)23-17-22(34-4)18-24(26(23)35-25(32)19-29)30-27(33)31(21-13-9-6-10-14-21)16-15-20-11-7-5-8-12-20;/h6,9-10,13-14,17-18,20H,5,7-8,11-12,15-16,19,29H2,1-4H3,(H,30,33);1H