ethyl 3-nitro-5-(1,3,4,5-tetrahydropyrido[4,3-b]indol-2-ylcarbonyl)benzoate

Systemtic Name: ethyl 3-nitro-5-(1,3,4,5-tetrahydropyrido[4,3-b]indol-2-ylcarbonyl)benzoate Openeye Name: ethyl 3-nitro-5-(1,3,4,5-tetrahydropyrido[4,3-b]indole-2-carbonyl)benzoate CAS Name: 3-nitro-5-[oxo(1,3,4,5-tetrahydropyrido[4,3-b]indol-2-yl)methyl]benzoic acid ethyl ester IUPAC Name: ethyl 3-nitro-5-(1,3,4,5-tetrahydropyrido[4,3-b]indole-2-carbonyl)benzoate Traditional Name: 3-nitro-5-(1,3,4,5-tetrahydropyrid[4,3-b]indole-2-carbonyl)benzoic acid ethyl ester Formula: C21H19N3O5 MolecularWeight: 393.39266

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=CC(=C1)C(=O)N2CCC3=C(C2)C4=CC=CC=C4N3)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1=CC(=CC(=C1)C(=O)N2CCC3=C(C2)C4=CC=CC=C4N3)[N+](=O)[O-]

InChI

InChI=1S/C21H19N3O5/c1-2-29-21(26)14-9-13(10-15(11-14)24(27)28)20(25)23-8-7-19-17(12-23)16-5-3-4-6-18(16)22-19/h3-6,9-11,22H,2,7-8,12H2,1H3