(1R,6S,7R)-N-(2-acetamidoethyl)-3-methoxy-7-methyl-4-oxidanylidene-6-phenyl-cyclohept-2-ene-1-carboxamide

Systemtic Name: (1R,6S,7R)-N-(2-acetamidoethyl)-3-methoxy-7-methyl-4-oxidanylidene-6-phenyl-cyclohept-2-ene-1-carboxamide Openeye Name: (1R,6S,7R)-N-(2-acetamidoethyl)-3-methoxy-7-methyl-4-oxo-6-phenyl-cyclohept-2-ene-1-carboxamide CAS Name: (1R,6S,7R)-N-(2-acetamidoethyl)-3-methoxy-7-methyl-4-oxo-6-phenyl-1-cyclohept-2-enecarboxamide IUPAC Name: (1R,6S,7R)-N-(2-acetamidoethyl)-3-methoxy-7-methyl-4-oxo-6-phenylcyclohept-2-ene-1-carboxamide Traditional Name: (1R,6S,7R)-N-(2-acetamidoethyl)-4-keto-3-methoxy-7-methyl-6-phenyl-cyclohept-2-ene-1-carboxamide Formula: C20H26N2O4 MolecularWeight: 358.43144

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(CC(=O)C(=CC1C(=O)NCCNC(=O)C)OC)C2=CC=CC=C2

Isomeric SMILES

C[C@@H]1[C@H](CC(=O)C(=C[C@@H]1C(=O)NCCNC(=O)C)OC)C2=CC=CC=C2

InChI

InChI=1S/C20H26N2O4/c1-13-16(15-7-5-4-6-8-15)11-18(24)19(26-3)12-17(13)20(25)22-10-9-21-14(2)23/h4-8,12-13,16-17H,9-11H2,1-3H3,(H,21,23)(H,22,25)/t13-,16+,17+/m1/s1