2-[4-(1,3-benzodioxol-4-ylmethyl)piperazin-1-yl]-1H-indole-3-carbaldehyde

Systemtic Name: 2-[4-(1,3-benzodioxol-4-ylmethyl)piperazin-1-yl]-1H-indole-3-carbaldehyde Openeye Name: 2-[4-(1,3-benzodioxol-4-ylmethyl)piperazin-1-yl]-1H-indole-3-carbaldehyde CAS Name: 2-[4-(1,3-benzodioxol-4-ylmethyl)-1-piperazinyl]-1H-indole-3-carboxaldehyde IUPAC Name: 2-[4-(1,3-benzodioxol-4-ylmethyl)piperazin-1-yl]-1H-indole-3-carbaldehyde Traditional Name: 2-[4-(1,3-benzodioxol-4-ylmethyl)piperazino]-1H-indole-3-carbaldehyde Formula: C21H21N3O3 MolecularWeight: 363.40974

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=C3C(=CC=C2)OCO3)C4=C(C5=CC=CC=C5N4)C=O

Isomeric SMILES

C1CN(CCN1CC2=C3C(=CC=C2)OCO3)C4=C(C5=CC=CC=C5N4)C=O

InChI

InChI=1S/C21H21N3O3/c25-13-17-16-5-1-2-6-18(16)22-21(17)24-10-8-23(9-11-24)12-15-4-3-7-19-20(15)27-14-26-19/h1-7,13,22H,8-12,14H2