(E,6S,7R)-N-(2-aminophenyl)-7-(4-methoxy-3-oxidanyl-phenyl)-6-methyl-7-oxidanyl-hept-2-enamide

Systemtic Name: (E,6S,7R)-N-(2-aminophenyl)-7-(4-methoxy-3-oxidanyl-phenyl)-6-methyl-7-oxidanyl-hept-2-enamide Openeye Name: (E,6S,7R)-N-(2-aminophenyl)-7-hydroxy-7-(3-hydroxy-4-methoxy-phenyl)-6-methyl-hept-2-enamide CAS Name: (E,6S,7R)-N-(2-aminophenyl)-7-hydroxy-7-(3-hydroxy-4-methoxyphenyl)-6-methyl-2-heptenamide IUPAC Name: (E,6S,7R)-N-(2-aminophenyl)-7-hydroxy-7-(3-hydroxy-4-methoxyphenyl)-6-methylhept-2-enamide Traditional Name: (E,6S,7R)-N-(2-aminophenyl)-7-hydroxy-7-(3-hydroxy-4-methoxy-phenyl)-6-methyl-hept-2-enamide Formula: C21H26N2O4 MolecularWeight: 370.44214

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCC=CC(=O)NC1=CC=CC=C1N)C(C2=CC(=C(C=C2)OC)O)O

Isomeric SMILES

C[C@@H](CC/C=C/C(=O)NC1=CC=CC=C1N)[C@H](C2=CC(=C(C=C2)OC)O)O

InChI

InChI=1S/C21H26N2O4/c1-14(21(26)15-11-12-19(27-2)18(24)13-15)7-3-6-10-20(25)23-17-9-5-4-8-16(17)22/h4-6,8-14,21,24,26H,3,7,22H2,1-2H3,(H,23,25)/b10-6+/t14-,21+/m0/s1