ethyl (2E)-2-(3-oxidanyl-3-phenyl-2,3a,4,5,6,7a-hexahydro-1H-indol-7-ylidene)ethanoate

Systemtic Name: ethyl (2E)-2-(3-oxidanyl-3-phenyl-2,3a,4,5,6,7a-hexahydro-1H-indol-7-ylidene)ethanoate Openeye Name: ethyl (2E)-2-(3-hydroxy-3-phenyl-2,3a,4,5,6,7a-hexahydro-1H-indol-7-ylidene)acetate CAS Name: (2E)-2-(3-hydroxy-3-phenyl-2,3a,4,5,6,7a-hexahydro-1H-indol-7-ylidene)acetic acid ethyl ester IUPAC Name: ethyl (2E)-2-(3-hydroxy-3-phenyl-2,3a,4,5,6,7a-hexahydro-1H-indol-7-ylidene)acetate Traditional Name: (2E)-2-(3-hydroxy-3-phenyl-2,3a,4,5,6,7a-hexahydro-1H-indol-7-ylidene)acetic acid ethyl ester Formula: C18H23NO3 MolecularWeight: 301.38012

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C=C1CCCC2C1NCC2(C3=CC=CC=C3)O

Isomeric SMILES

CCOC(=O)/C=C/1\CCCC2C1NCC2(C3=CC=CC=C3)O

InChI

InChI=1S/C18H23NO3/c1-2-22-16(20)11-13-7-6-10-15-17(13)19-12-18(15,21)14-8-4-3-5-9-14/h3-5,8-9,11,15,17,19,21H,2,6-7,10,12H2,1H3/b13-11+