(9Z)-2-ethanoyl-7-(naphthalen-1-ylcarbonylamino)-6-oxidanylidene-3,4,7,8,11,11a-hexahydro-1H-pyrazino[1,2-a]azocine-4-carboxylic acid

Systemtic Name: (9Z)-2-ethanoyl-7-(naphthalen-1-ylcarbonylamino)-6-oxidanylidene-3,4,7,8,11,11a-hexahydro-1H-pyrazino[1,2-a]azocine-4-carboxylic acid Openeye Name: (9Z)-2-acetyl-7-(naphthalene-1-carbonylamino)-6-oxo-3,4,7,8,11,11a-hexahydro-1H-pyrazino[1,2-a]azocine-4-carboxylic acid CAS Name: (9Z)-2-acetyl-7-[[1-naphthalenyl(oxo)methyl]amino]-6-oxo-3,4,7,8,11,11a-hexahydro-1H-pyrazino[1,2-a]azocine-4-carboxylic acid IUPAC Name: (9Z)-2-acetyl-7-(naphthalene-1-carbonylamino)-6-oxo-3,4,7,8,11,11a-hexahydro-1H-pyrazino[1,2-a]azocine-4-carboxylic acid Traditional Name: (9Z)-2-acetyl-6-keto-7-(1-naphthoylamino)-3,4,7,8,11,11a-hexahydro-1H-pyrazin[1,2-a]azocine-4-carboxylic acid Formula: C24H25N3O5 MolecularWeight: 435.4724

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CC2CC=CCC(C(=O)N2C(C1)C(=O)O)NC(=O)C3=CC=CC4=CC=CC=C43

Isomeric SMILES

CC(=O)N1CC2C/C=C\CC(C(=O)N2C(C1)C(=O)O)NC(=O)C3=CC=CC4=CC=CC=C43

InChI

InChI=1S/C24H25N3O5/c1-15(28)26-13-17-9-3-5-12-20(23(30)27(17)21(14-26)24(31)32)25-22(29)19-11-6-8-16-7-2-4-10-18(16)19/h2-8,10-11,17,20-21H,9,12-14H2,1H3,(H,25,29)(H,31,32)/b5-3-