(5-chloranyl-1H-indol-2-yl)-[4-[(4-methoxyphenyl)methyl]piperazin-4-ium-1-yl]methanone

Systemtic Name: (5-chloranyl-1H-indol-2-yl)-[4-[(4-methoxyphenyl)methyl]piperazin-4-ium-1-yl]methanone Openeye Name: (5-chloro-1H-indol-2-yl)-[4-[(4-methoxyphenyl)methyl]piperazin-4-ium-1-yl]methanone CAS Name: (5-chloro-1H-indol-2-yl)-[4-[(4-methoxyphenyl)methyl]-1-piperazin-4-iumyl]methanone IUPAC Name: (5-chloro-1H-indol-2-yl)-[4-[(4-methoxyphenyl)methyl]piperazin-4-ium-1-yl]methanone Traditional Name: (5-chloro-1H-indol-2-yl)-(4-p-anisylpiperazin-4-ium-1-yl)methanone Formula: C21H23ClN3O2+ MolecularWeight: 384.87922

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C[NH+]2CCN(CC2)C(=O)C3=CC4=C(N3)C=CC(=C4)Cl

Isomeric SMILES

COC1=CC=C(C=C1)C[NH+]2CCN(CC2)C(=O)C3=CC4=C(N3)C=CC(=C4)Cl

InChI

InChI=1S/C21H22ClN3O2/c1-27-18-5-2-15(3-6-18)14-24-8-10-25(11-9-24)21(26)20-13-16-12-17(22)4-7-19(16)23-20/h2-7,12-13,23H,8-11,14H2,1H3/p+1