ethyl 2-(2,3,3a,4-tetrahydro-1H-pyrrolo[1,2-a]quinoxalin-5-ylcarbonylamino)benzoate

Systemtic Name: ethyl 2-(2,3,3a,4-tetrahydro-1H-pyrrolo[1,2-a]quinoxalin-5-ylcarbonylamino)benzoate Openeye Name: ethyl 2-(2,3,3a,4-tetrahydro-1H-pyrrolo[1,2-a]quinoxaline-5-carbonylamino)benzoate CAS Name: 2-[[2,3,3a,4-tetrahydro-1H-pyrrolo[1,2-a]quinoxalin-5-yl(oxo)methyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 2-(2,3,3a,4-tetrahydro-1H-pyrrolo[1,2-a]quinoxaline-5-carbonylamino)benzoate Traditional Name: 2-(2,3,3a,4-tetrahydro-1H-pyrrolo[1,2-a]quinoxaline-5-carbonylamino)benzoic acid ethyl ester Formula: C21H23N3O3 MolecularWeight: 365.42562

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=CC=C1NC(=O)N2CC3CCCN3C4=CC=CC=C42

Isomeric SMILES

CCOC(=O)C1=CC=CC=C1NC(=O)N2CC3CCCN3C4=CC=CC=C42

InChI

InChI=1S/C21H23N3O3/c1-2-27-20(25)16-9-3-4-10-17(16)22-21(26)24-14-15-8-7-13-23(15)18-11-5-6-12-19(18)24/h3-6,9-12,15H,2,7-8,13-14H2,1H3,(H,22,26)