[2-tert-butyl-6-[[cycloheptyl-(4-dimethylaminophenyl)carbamoyl]amino]-4-methoxy-phenyl] ethanoate hydrochloride

Systemtic Name: [2-tert-butyl-6-[[cycloheptyl-(4-dimethylaminophenyl)carbamoyl]amino]-4-methoxy-phenyl] ethanoate hydrochloride Openeye Name: [2-tert-butyl-6-[[cycloheptyl-(4-dimethylaminophenyl)carbamoyl]amino]-4-methoxy-phenyl] acetate hydrochloride CAS Name: acetic acid [2-tert-butyl-6-[[[N-cycloheptyl-4-(dimethylamino)anilino]-oxomethyl]amino]-4-methoxyphenyl] ester hydrochloride IUPAC Name: [2-tert-butyl-6-[[cycloheptyl-(4-dimethylaminophenyl)carbamoyl]amino]-4-methoxyphenyl] acetate hydrochloride Traditional Name: acetic acid [2-tert-butyl-6-[[cycloheptyl-(4-dimethylaminophenyl)carbamoyl]amino]-4-methoxy-phenyl] ester hydrochloride Formula: C29H42ClN3O4 MolecularWeight: 532.11448

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1=C(C=C(C=C1C(C)(C)C)OC)NC(=O)N(C2CCCCCC2)C3=CC=C(C=C3)N(C)C.Cl

Isomeric SMILES

CC(=O)OC1=C(C=C(C=C1C(C)(C)C)OC)NC(=O)N(C2CCCCCC2)C3=CC=C(C=C3)N(C)C.Cl

InChI

InChI=1S/C29H41N3O4.ClH/c1-20(33)36-27-25(29(2,3)4)18-24(35-7)19-26(27)30-28(34)32(22-12-10-8-9-11-13-22)23-16-14-21(15-17-23)31(5)6;/h14-19,22H,8-13H2,1-7H3,(H,30,34);1H