N-[4-[butyl(furan-2-ylmethyl)amino]-3-(propylcarbamoyl)phenyl]-4-methyl-3-nitro-benzamide

Systemtic Name: N-[4-[butyl(furan-2-ylmethyl)amino]-3-(propylcarbamoyl)phenyl]-4-methyl-3-nitro-benzamide Openeye Name: N-[4-[butyl(2-furylmethyl)amino]-3-(propylcarbamoyl)phenyl]-4-methyl-3-nitro-benzamide CAS Name: N-[4-[butyl(2-furanylmethyl)amino]-3-[oxo(propylamino)methyl]phenyl]-4-methyl-3-nitrobenzamide IUPAC Name: N-[4-[butyl(furan-2-ylmethyl)amino]-3-(propylcarbamoyl)phenyl]-4-methyl-3-nitrobenzamide Traditional Name: N-[4-[butyl(2-furfuryl)amino]-3-(propylcarbamoyl)phenyl]-4-methyl-3-nitro-benzamide Formula: C27H32N4O5 MolecularWeight: 492.56678

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CC1=CC=CO1)C2=C(C=C(C=C2)NC(=O)C3=CC(=C(C=C3)C)[N+](=O)[O-])C(=O)NCCC

Isomeric SMILES

CCCCN(CC1=CC=CO1)C2=C(C=C(C=C2)NC(=O)C3=CC(=C(C=C3)C)[N+](=O)[O-])C(=O)NCCC

InChI

InChI=1S/C27H32N4O5/c1-4-6-14-30(18-22-8-7-15-36-22)24-12-11-21(17-23(24)27(33)28-13-5-2)29-26(32)20-10-9-19(3)25(16-20)31(34)35/h7-12,15-17H,4-6,13-14,18H2,1-3H3,(H,28,33)(H,29,32)