2-azanyl-N-(3-tert-butyl-5-methoxy-2-oxidanyl-phenyl)-N-[cycloheptyl-(4-dimethylaminophenyl)carbamoyl]ethanamide dihydrochloride

Systemtic Name: 2-azanyl-N-(3-tert-butyl-5-methoxy-2-oxidanyl-phenyl)-N-[cycloheptyl-(4-dimethylaminophenyl)carbamoyl]ethanamide dihydrochloride Openeye Name: 2-amino-N-(3-tert-butyl-2-hydroxy-5-methoxy-phenyl)-N-[cycloheptyl-(4-dimethylaminophenyl)carbamoyl]acetamide dihydrochloride CAS Name: 2-amino-N-(3-tert-butyl-2-hydroxy-5-methoxyphenyl)-N-[[N-cycloheptyl-4-(dimethylamino)anilino]-oxomethyl]acetamide dihydrochloride IUPAC Name: 2-amino-N-(3-tert-butyl-2-hydroxy-5-methoxyphenyl)-N-[cycloheptyl-(4-dimethylaminophenyl)carbamoyl]acetamide dihydrochloride Traditional Name: 2-amino-N-(3-tert-butyl-2-hydroxy-5-methoxy-phenyl)-N-[cycloheptyl-(4-dimethylaminophenyl)carbamoyl]acetamide dihydrochloride Formula: C29H44Cl2N4O4 MolecularWeight: 583.59006

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=CC(=C1O)N(C(=O)CN)C(=O)N(C2CCCCCC2)C3=CC=C(C=C3)N(C)C)OC.Cl.Cl

Isomeric SMILES

CC(C)(C)C1=CC(=CC(=C1O)N(C(=O)CN)C(=O)N(C2CCCCCC2)C3=CC=C(C=C3)N(C)C)OC.Cl.Cl

InChI

InChI=1S/C29H42N4O4.2ClH/c1-29(2,3)24-17-23(37-6)18-25(27(24)35)33(26(34)19-30)28(36)32(21-11-9-7-8-10-12-21)22-15-13-20(14-16-22)31(4)5;;/h13-18,21,35H,7-12,19,30H2,1-6H3;2*1H