N-butyl-N-[2-[(4-fluorophenyl)methyl-[(4-oxidanylidenechromen-3-yl)methyl]amino]-2-oxidanylidene-ethyl]-4-methyl-3-nitro-benzamide

Systemtic Name: N-butyl-N-[2-[(4-fluorophenyl)methyl-[(4-oxidanylidenechromen-3-yl)methyl]amino]-2-oxidanylidene-ethyl]-4-methyl-3-nitro-benzamide Openeye Name: N-butyl-N-[2-[(4-fluorophenyl)methyl-[(4-oxochromen-3-yl)methyl]amino]-2-oxo-ethyl]-4-methyl-3-nitro-benzamide CAS Name: N-butyl-N-[2-[(4-fluorophenyl)methyl-[(4-oxo-1-benzopyran-3-yl)methyl]amino]-2-oxoethyl]-4-methyl-3-nitrobenzamide IUPAC Name: N-butyl-N-[2-[(4-fluorophenyl)methyl-[(4-oxochromen-3-yl)methyl]amino]-2-oxoethyl]-4-methyl-3-nitrobenzamide Traditional Name: N-butyl-N-[2-[(4-fluorobenzyl)-[(4-ketochromen-3-yl)methyl]amino]-2-keto-ethyl]-4-methyl-3-nitro-benzamide Formula: C31H30FN3O6 MolecularWeight: 559.584803

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CC(=O)N(CC1=CC=C(C=C1)F)CC2=COC3=CC=CC=C3C2=O)C(=O)C4=CC(=C(C=C4)C)[N+](=O)[O-]

Isomeric SMILES

CCCCN(CC(=O)N(CC1=CC=C(C=C1)F)CC2=COC3=CC=CC=C3C2=O)C(=O)C4=CC(=C(C=C4)C)[N+](=O)[O-]

InChI

InChI=1S/C31H30FN3O6/c1-3-4-15-33(31(38)23-12-9-21(2)27(16-23)35(39)40)19-29(36)34(17-22-10-13-25(32)14-11-22)18-24-20-41-28-8-6-5-7-26(28)30(24)37/h5-14,16,20H,3-4,15,17-19H2,1-2H3