[4-[(9-ethylcarbazol-3-yl)methyl]piperazin-4-ium-1-yl]-(3-methoxyphenyl)methanone

Systemtic Name: [4-[(9-ethylcarbazol-3-yl)methyl]piperazin-4-ium-1-yl]-(3-methoxyphenyl)methanone Openeye Name: [4-[(9-ethylcarbazol-3-yl)methyl]piperazin-4-ium-1-yl]-(3-methoxyphenyl)methanone CAS Name: [4-[(9-ethyl-3-carbazolyl)methyl]-1-piperazin-4-iumyl]-(3-methoxyphenyl)methanone IUPAC Name: [4-[(9-ethylcarbazol-3-yl)methyl]piperazin-4-ium-1-yl]-(3-methoxyphenyl)methanone Traditional Name: [4-[(9-ethylcarbazol-3-yl)methyl]piperazin-4-ium-1-yl]-(3-methoxyphenyl)methanone Formula: C27H30N3O2+ MolecularWeight: 428.546

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)C[NH+]3CCN(CC3)C(=O)C4=CC(=CC=C4)OC)C5=CC=CC=C51

Isomeric SMILES

CCN1C2=C(C=C(C=C2)C[NH+]3CCN(CC3)C(=O)C4=CC(=CC=C4)OC)C5=CC=CC=C51

InChI

InChI=1S/C27H29N3O2/c1-3-30-25-10-5-4-9-23(25)24-17-20(11-12-26(24)30)19-28-13-15-29(16-14-28)27(31)21-7-6-8-22(18-21)32-2/h4-12,17-18H,3,13-16,19H2,1-2H3/p+1