N-benzo[c]phenanthren-5-ylethanamide; 2,4,7-trinitrofluoren-9-one

Systemtic Name: N-benzo[c]phenanthren-5-ylethanamide; 2,4,7-trinitrofluoren-9-one Openeye Name: N-benzo[c]phenanthren-5-ylacetamide; 2,4,7-trinitrofluoren-9-one CAS Name: N-(5-benzo[c]phenanthrenyl)acetamide; 2,4,7-trinitro-9-fluorenone IUPAC Name: N-benzo[c]phenanthren-5-ylacetamide; 2,4,7-trinitrofluoren-9-one Traditional Name: N-benzo[c]phenanthren-5-ylacetamide; 2,4,7-trinitrofluoren-9-one Formula: C33H20N4O8 MolecularWeight: 600.5339

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC2=C(C3=CC=CC=C3C=C2)C4=CC=CC=C41.C1=CC2=C(C=C1[N+](=O)[O-])C(=O)C3=CC(=CC(=C23)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CC(=O)NC1=CC2=C(C3=CC=CC=C3C=C2)C4=CC=CC=C41.C1=CC2=C(C=C1[N+](=O)[O-])C(=O)C3=CC(=CC(=C23)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C20H15NO.C13H5N3O7/c1-13(22)21-19-12-15-11-10-14-6-2-3-7-16(14)20(15)18-9-5-4-8-17(18)19;17-13-9-3-6(14(18)19)1-2-8(9)12-10(13)4-7(15(20)21)5-11(12)16(22)23/h2-12H,1H3,(H,21,22);1-5H