(3-butyl-1-methyl-5-nitro-indol-2-yl)-[4-[3-(dibutylamino)propoxy]phenyl]methanone

Systemtic Name: (3-butyl-1-methyl-5-nitro-indol-2-yl)-[4-[3-(dibutylamino)propoxy]phenyl]methanone Openeye Name: (3-butyl-1-methyl-5-nitro-indol-2-yl)-[4-[3-(dibutylamino)propoxy]phenyl]methanone CAS Name: (3-butyl-1-methyl-5-nitro-2-indolyl)-[4-[3-(dibutylamino)propoxy]phenyl]methanone IUPAC Name: (3-butyl-1-methyl-5-nitroindol-2-yl)-[4-[3-(dibutylamino)propoxy]phenyl]methanone Traditional Name: (3-butyl-1-methyl-5-nitro-indol-2-yl)-[4-[3-(dibutylamino)propoxy]phenyl]methanone Formula: C31H43N3O4 MolecularWeight: 521.69082

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(N(C2=C1C=C(C=C2)[N+](=O)[O-])C)C(=O)C3=CC=C(C=C3)OCCCN(CCCC)CCCC

Isomeric SMILES

CCCCC1=C(N(C2=C1C=C(C=C2)[N+](=O)[O-])C)C(=O)C3=CC=C(C=C3)OCCCN(CCCC)CCCC

InChI

InChI=1S/C31H43N3O4/c1-5-8-12-27-28-23-25(34(36)37)15-18-29(28)32(4)30(27)31(35)24-13-16-26(17-14-24)38-22-11-21-33(19-9-6-2)20-10-7-3/h13-18,23H,5-12,19-22H2,1-4H3