[5-methoxy-1-(phenylmethyl)indol-2-yl]-piperazin-4-ium-1-yl-methanone

Systemtic Name: [5-methoxy-1-(phenylmethyl)indol-2-yl]-piperazin-4-ium-1-yl-methanone Openeye Name: (1-benzyl-5-methoxy-indol-2-yl)-piperazin-4-ium-1-yl-methanone CAS Name: [5-methoxy-1-(phenylmethyl)-2-indolyl]-(1-piperazin-4-iumyl)methanone IUPAC Name: (1-benzyl-5-methoxyindol-2-yl)-piperazin-4-ium-1-ylmethanone Traditional Name: (1-benzyl-5-methoxy-indol-2-yl)-piperazin-4-ium-1-yl-methanone Formula: C21H24N3O2+ MolecularWeight: 350.43416

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)N(C(=C2)C(=O)N3CC[NH2+]CC3)CC4=CC=CC=C4

Isomeric SMILES

COC1=CC2=C(C=C1)N(C(=C2)C(=O)N3CC[NH2+]CC3)CC4=CC=CC=C4

InChI

InChI=1S/C21H23N3O2/c1-26-18-7-8-19-17(13-18)14-20(21(25)23-11-9-22-10-12-23)24(19)15-16-5-3-2-4-6-16/h2-8,13-14,22H,9-12,15H2,1H3/p+1