2-(3,6-dinitrocarbazol-9-yl)ethyl benzoate

Systemtic Name: 2-(3,6-dinitrocarbazol-9-yl)ethyl benzoate Openeye Name: 2-(3,6-dinitrocarbazol-9-yl)ethyl benzoate CAS Name: benzoic acid 2-(3,6-dinitro-9-carbazolyl)ethyl ester IUPAC Name: 2-(3,6-dinitrocarbazol-9-yl)ethyl benzoate Traditional Name: benzoic acid 2-(3,6-dinitrocarbazol-9-yl)ethyl ester Formula: C21H15N3O6 MolecularWeight: 405.3603

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)OCCN2C3=C(C=C(C=C3)[N+](=O)[O-])C4=C2C=CC(=C4)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)C(=O)OCCN2C3=C(C=C(C=C3)[N+](=O)[O-])C4=C2C=CC(=C4)[N+](=O)[O-]

InChI

InChI=1S/C21H15N3O6/c25-21(14-4-2-1-3-5-14)30-11-10-22-19-8-6-15(23(26)27)12-17(19)18-13-16(24(28)29)7-9-20(18)22/h1-9,12-13H,10-11H2