methyl 10-acetyloxy-13-(phenylmethyl)-13-azabicyclo[9.2.1]tetradeca-1(14),11-diene-9-carboxylate

Systemtic Name: methyl 10-acetyloxy-13-(phenylmethyl)-13-azabicyclo[9.2.1]tetradeca-1(14),11-diene-9-carboxylate Openeye Name: methyl 10-acetoxy-13-benzyl-13-azabicyclo[9.2.1]tetradeca-1(14),11-diene-9-carboxylate CAS Name: 10-acetyloxy-13-(phenylmethyl)-13-azabicyclo[9.2.1]tetradeca-1(14),11-diene-9-carboxylic acid methyl ester IUPAC Name: methyl 10-acetyloxy-13-benzyl-13-azabicyclo[9.2.1]tetradeca-1(14),11-diene-9-carboxylate Traditional Name: 10-acetoxy-13-benzyl-13-azabicyclo[9.2.1]tetradeca-1(14),11-diene-9-carboxylic acid methyl ester Formula: C24H31NO4 MolecularWeight: 397.50724

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1C(CCCCCCCC2=CC1=CN2CC3=CC=CC=C3)C(=O)OC

Isomeric SMILES

CC(=O)OC1C(CCCCCCCC2=CC1=CN2CC3=CC=CC=C3)C(=O)OC

InChI

InChI=1S/C24H31NO4/c1-18(26)29-23-20-15-21(25(17-20)16-19-11-7-6-8-12-19)13-9-4-3-5-10-14-22(23)24(27)28-2/h6-8,11-12,15,17,22-23H,3-5,9-10,13-14,16H2,1-2H3