N-butyl-N-[2-[4-(4-methoxyphenyl)-4H-pyrrolo[1,2-a]quinoxalin-5-yl]-2-oxidanylidene-ethyl]-4-nitro-benzamide

Systemtic Name: N-butyl-N-[2-[4-(4-methoxyphenyl)-4H-pyrrolo[1,2-a]quinoxalin-5-yl]-2-oxidanylidene-ethyl]-4-nitro-benzamide Openeye Name: N-butyl-N-[2-[4-(4-methoxyphenyl)-4H-pyrrolo[1,2-a]quinoxalin-5-yl]-2-oxo-ethyl]-4-nitro-benzamide CAS Name: N-butyl-N-[2-[4-(4-methoxyphenyl)-4H-pyrrolo[1,2-a]quinoxalin-5-yl]-2-oxoethyl]-4-nitrobenzamide IUPAC Name: N-butyl-N-[2-[4-(4-methoxyphenyl)-4H-pyrrolo[1,2-a]quinoxalin-5-yl]-2-oxoethyl]-4-nitrobenzamide Traditional Name: N-butyl-N-[2-keto-2-[4-(4-methoxyphenyl)-4H-pyrrolo[1,2-a]quinoxalin-5-yl]ethyl]-4-nitro-benzamide Formula: C31H30N4O5 MolecularWeight: 538.5937

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CC(=O)N1C(C2=CC=CN2C3=CC=CC=C31)C4=CC=C(C=C4)OC)C(=O)C5=CC=C(C=C5)[N+](=O)[O-]

Isomeric SMILES

CCCCN(CC(=O)N1C(C2=CC=CN2C3=CC=CC=C31)C4=CC=C(C=C4)OC)C(=O)C5=CC=C(C=C5)[N+](=O)[O-]

InChI

InChI=1S/C31H30N4O5/c1-3-4-19-32(31(37)23-11-15-24(16-12-23)35(38)39)21-29(36)34-27-9-6-5-8-26(27)33-20-7-10-28(33)30(34)22-13-17-25(40-2)18-14-22/h5-18,20,30H,3-4,19,21H2,1-2H3