ethyl 5-tert-butyl-1-[[cycloheptyl-(4-dimethylaminophenyl)carbamoyl]amino]-3-methoxy-6-oxidanyl-cyclohexa-2,4-diene-1-carboxylate hydrochloride

Systemtic Name: ethyl 5-tert-butyl-1-[[cycloheptyl-(4-dimethylaminophenyl)carbamoyl]amino]-3-methoxy-6-oxidanyl-cyclohexa-2,4-diene-1-carboxylate hydrochloride Openeye Name: ethyl 5-tert-butyl-1-[[cycloheptyl-(4-dimethylaminophenyl)carbamoyl]amino]-6-hydroxy-3-methoxy-cyclohexa-2,4-diene-1-carboxylate hydrochloride CAS Name: 5-tert-butyl-1-[[[N-cycloheptyl-4-(dimethylamino)anilino]-oxomethyl]amino]-6-hydroxy-3-methoxy-1-cyclohexa-2,4-dienecarboxylic acid ethyl ester hydrochloride IUPAC Name: ethyl 5-tert-butyl-1-[[cycloheptyl-(4-dimethylaminophenyl)carbamoyl]amino]-6-hydroxy-3-methoxycyclohexa-2,4-diene-1-carboxylate hydrochloride Traditional Name: 5-tert-butyl-1-[[cycloheptyl-(4-dimethylaminophenyl)carbamoyl]amino]-6-hydroxy-3-methoxy-cyclohexa-2,4-diene-1-carboxylic acid ethyl ester hydrochloride Formula: C30H46ClN3O5 MolecularWeight: 564.15634

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C30H45N3O5.ClH/c1-8-38-27(35)30(20-24(37-7)19-25(26(30)34)29(2,3)4)31-28(36)33(22-13-11-9-10-12-14-22)23-17-15-21(16-18-23)32(5)6;/h15-20,22,26,34H,8-14H2,1-7H3,(H,31,36);1H