4-[3-(4-azanylbutyl)-5-phenylmethoxy-1H-indol-2-yl]-N,N-diethyl-aniline

Systemtic Name: 4-[3-(4-azanylbutyl)-5-phenylmethoxy-1H-indol-2-yl]-N,N-diethyl-aniline Openeye Name: 4-[3-(4-aminobutyl)-5-benzyloxy-1H-indol-2-yl]-N,N-diethyl-aniline CAS Name: 4-[3-(4-aminobutyl)-5-phenylmethoxy-1H-indol-2-yl]-N,N-diethylaniline IUPAC Name: 4-[3-(4-aminobutyl)-5-phenylmethoxy-1H-indol-2-yl]-N,N-diethylaniline Traditional Name: [4-[3-(4-aminobutyl)-5-benzoxy-1H-indol-2-yl]phenyl]-diethyl-amine Formula: C29H35N3O MolecularWeight: 441.6077

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=CC=C(C=C1)C2=C(C3=C(N2)C=CC(=C3)OCC4=CC=CC=C4)CCCCN

Isomeric SMILES

CCN(CC)C1=CC=C(C=C1)C2=C(C3=C(N2)C=CC(=C3)OCC4=CC=CC=C4)CCCCN

InChI

InChI=1S/C29H35N3O/c1-3-32(4-2)24-15-13-23(14-16-24)29-26(12-8-9-19-30)27-20-25(17-18-28(27)31-29)33-21-22-10-6-5-7-11-22/h5-7,10-11,13-18,20,31H,3-4,8-9,12,19,21,30H2,1-2H3