N-butyl-N-[2-[(6-methyl-4-oxidanylidene-chromen-3-yl)methyl-(phenylmethyl)amino]-2-oxidanylidene-ethyl]-4-nitro-benzamide

Systemtic Name: N-butyl-N-[2-[(6-methyl-4-oxidanylidene-chromen-3-yl)methyl-(phenylmethyl)amino]-2-oxidanylidene-ethyl]-4-nitro-benzamide Openeye Name: N-[2-[benzyl-[(6-methyl-4-oxo-chromen-3-yl)methyl]amino]-2-oxo-ethyl]-N-butyl-4-nitro-benzamide CAS Name: N-butyl-N-[2-[(6-methyl-4-oxo-1-benzopyran-3-yl)methyl-(phenylmethyl)amino]-2-oxoethyl]-4-nitrobenzamide IUPAC Name: N-[2-[benzyl-[(6-methyl-4-oxochromen-3-yl)methyl]amino]-2-oxoethyl]-N-butyl-4-nitrobenzamide Traditional Name: N-[2-[benzyl-[(4-keto-6-methyl-chromen-3-yl)methyl]amino]-2-keto-ethyl]-N-butyl-4-nitro-benzamide Formula: C31H31N3O6 MolecularWeight: 541.59434

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CC(=O)N(CC1=CC=CC=C1)CC2=COC3=C(C2=O)C=C(C=C3)C)C(=O)C4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

CCCCN(CC(=O)N(CC1=CC=CC=C1)CC2=COC3=C(C2=O)C=C(C=C3)C)C(=O)C4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C31H31N3O6/c1-3-4-16-32(31(37)24-11-13-26(14-12-24)34(38)39)20-29(35)33(18-23-8-6-5-7-9-23)19-25-21-40-28-15-10-22(2)17-27(28)30(25)36/h5-15,17,21H,3-4,16,18-20H2,1-2H3