N-[[4-[2-(methylamino)-2-oxidanylidene-ethyl]-2-nitro-phenyl]methyl]benzo[lmn]phenanthridine-2-carboxamide

Systemtic Name: N-[[4-[2-(methylamino)-2-oxidanylidene-ethyl]-2-nitro-phenyl]methyl]benzo[lmn]phenanthridine-2-carboxamide Openeye Name: N-[[4-[2-(methylamino)-2-oxo-ethyl]-2-nitro-phenyl]methyl]benzo[lmn]phenanthridine-2-carboxamide CAS Name: N-[[4-[2-(methylamino)-2-oxoethyl]-2-nitrophenyl]methyl]-2-benzo[lmn]phenanthridinecarboxamide IUPAC Name: N-[[4-[2-(methylamino)-2-oxoethyl]-2-nitrophenyl]methyl]benzo[lmn]phenanthridine-2-carboxamide Traditional Name: N-[4-[2-keto-2-(methylamino)ethyl]-2-nitro-benzyl]thebenidine-2-carboxamide Formula: C26H20N4O4 MolecularWeight: 452.4614

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)CC1=CC(=C(C=C1)CNC(=O)C2=CC3=C4C(=C2)C=CC5=C4C(=CC=C5)C=N3)[N+](=O)[O-]

Isomeric SMILES

CNC(=O)CC1=CC(=C(C=C1)CNC(=O)C2=CC3=C4C(=C2)C=CC5=C4C(=CC=C5)C=N3)[N+](=O)[O-]

InChI

InChI=1S/C26H20N4O4/c1-27-23(31)10-15-5-6-18(22(9-15)30(33)34)13-29-26(32)20-11-17-8-7-16-3-2-4-19-14-28-21(12-20)25(17)24(16)19/h2-9,11-12,14H,10,13H2,1H3,(H,27,31)(H,29,32)