N-[3-[2-bromanyl-4-[(2-butyl-1-methyl-indolizin-3-yl)methyl]phenoxy]propyl]-N-butyl-butan-1-amine

Systemtic Name: N-[3-[2-bromanyl-4-[(2-butyl-1-methyl-indolizin-3-yl)methyl]phenoxy]propyl]-N-butyl-butan-1-amine Openeye Name: N-[3-[2-bromo-4-[(2-butyl-1-methyl-indolizin-3-yl)methyl]phenoxy]propyl]-N-butyl-butan-1-amine CAS Name: N-[3-[2-bromo-4-[(2-butyl-1-methyl-3-indolizinyl)methyl]phenoxy]propyl]-N-butyl-1-butanamine IUPAC Name: N-[3-[2-bromo-4-[(2-butyl-1-methylindolizin-3-yl)methyl]phenoxy]propyl]-N-butylbutan-1-amine Traditional Name: 3-[2-bromo-4-[(2-butyl-1-methyl-indolizin-3-yl)methyl]phenoxy]propyl-dibutyl-amine Formula: C31H45BrN2O MolecularWeight: 541.6058

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(N2C=CC=CC2=C1C)CC3=CC(=C(C=C3)OCCCN(CCCC)CCCC)Br

Isomeric SMILES

CCCCC1=C(N2C=CC=CC2=C1C)CC3=CC(=C(C=C3)OCCCN(CCCC)CCCC)Br

InChI

InChI=1S/C31H45BrN2O/c1-5-8-14-27-25(4)29-15-11-12-21-34(29)30(27)24-26-16-17-31(28(32)23-26)35-22-13-20-33(18-9-6-2)19-10-7-3/h11-12,15-17,21,23H,5-10,13-14,18-20,22,24H2,1-4H3