N-(2,3-dihydro-1H-inden-5-yl)-3-(4-phenylpiperazin-1-ium-1-yl)propanamide

Systemtic Name: N-(2,3-dihydro-1H-inden-5-yl)-3-(4-phenylpiperazin-1-ium-1-yl)propanamide Openeye Name: N-indan-5-yl-3-(4-phenylpiperazin-1-ium-1-yl)propanamide CAS Name: N-(2,3-dihydro-1H-inden-5-yl)-3-(4-phenyl-1-piperazin-1-iumyl)propanamide IUPAC Name: N-(2,3-dihydro-1H-inden-5-yl)-3-(4-phenylpiperazin-1-ium-1-yl)propanamide Traditional Name: N-indan-5-yl-3-(4-phenylpiperazin-1-ium-1-yl)propionamide Formula: C22H28N3O+ MolecularWeight: 350.47722

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C1)C=C(C=C2)NC(=O)CC[NH+]3CCN(CC3)C4=CC=CC=C4

Isomeric SMILES

C1CC2=C(C1)C=C(C=C2)NC(=O)CC[NH+]3CCN(CC3)C4=CC=CC=C4

InChI

InChI=1S/C22H27N3O/c26-22(23-20-10-9-18-5-4-6-19(18)17-20)11-12-24-13-15-25(16-14-24)21-7-2-1-3-8-21/h1-3,7-10,17H,4-6,11-16H2,(H,23,26)/p+1