2,3-bis(oxidanyl)butanedioic acid; (E)-3-[4-(2-dimethylaminoethyloxy)-3-methoxy-phenyl]-N-(4-methylcyclohexyl)prop-2-enamide

Systemtic Name: 2,3-bis(oxidanyl)butanedioic acid; (E)-3-[4-(2-dimethylaminoethyloxy)-3-methoxy-phenyl]-N-(4-methylcyclohexyl)prop-2-enamide Openeye Name: 2,3-dihydroxybutanedioic acid; (E)-3-[4-(2-dimethylaminoethyloxy)-3-methoxy-phenyl]-N-(4-methylcyclohexyl)prop-2-enamide CAS Name: 2,3-dihydroxybutanedioic acid; (E)-3-[4-(2-dimethylaminoethyloxy)-3-methoxyphenyl]-N-(4-methylcyclohexyl)-2-propenamide IUPAC Name: 2,3-dihydroxybutanedioic acid; (E)-3-[4-(2-dimethylaminoethyloxy)-3-methoxyphenyl]-N-(4-methylcyclohexyl)prop-2-enamide Traditional Name: (E)-3-[4-(2-dimethylaminoethyloxy)-3-methoxy-phenyl]-N-(4-methylcyclohexyl)acrylamide; tartaric acid Formula: C25H38N2O9 MolecularWeight: 510.57722

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(CC1)NC(=O)C=CC2=CC(=C(C=C2)OCCN(C)C)OC.C(C(C(=O)O)O)(C(=O)O)O

Isomeric SMILES

CC1CCC(CC1)NC(=O)/C=C/C2=CC(=C(C=C2)OCCN(C)C)OC.C(C(C(=O)O)O)(C(=O)O)O

InChI

InChI=1S/C21H32N2O3.C4H6O6/c1-16-5-9-18(10-6-16)22-21(24)12-8-17-7-11-19(20(15-17)25-4)26-14-13-23(2)3;5-1(3(7)8)2(6)4(9)10/h7-8,11-12,15-16,18H,5-6,9-10,13-14H2,1-4H3,(H,22,24);1-2,5-6H,(H,7,8)(H,9,10)/b12-8+;