(1-methylindol-3-yl)-[4-(phenylmethyl)piperazin-4-ium-1-yl]methanone

Systemtic Name: (1-methylindol-3-yl)-[4-(phenylmethyl)piperazin-4-ium-1-yl]methanone Openeye Name: (4-benzylpiperazin-4-ium-1-yl)-(1-methylindol-3-yl)methanone CAS Name: (1-methyl-3-indolyl)-[4-(phenylmethyl)-1-piperazin-4-iumyl]methanone IUPAC Name: (4-benzylpiperazin-4-ium-1-yl)-(1-methylindol-3-yl)methanone Traditional Name: (4-benzylpiperazin-4-ium-1-yl)-(1-methylindol-3-yl)methanone Formula: C21H24N3O+ MolecularWeight: 334.43476

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C2=CC=CC=C21)C(=O)N3CC[NH+](CC3)CC4=CC=CC=C4

Isomeric SMILES

CN1C=C(C2=CC=CC=C21)C(=O)N3CC[NH+](CC3)CC4=CC=CC=C4

InChI

InChI=1S/C21H23N3O/c1-22-16-19(18-9-5-6-10-20(18)22)21(25)24-13-11-23(12-14-24)15-17-7-3-2-4-8-17/h2-10,16H,11-15H2,1H3/p+1