N-(phenylmethyl)-2-[4-(5,6,7,8-tetrahydronaphthalen-2-ylcarbonyl)piperazin-1-ium-1-yl]ethanamide

Systemtic Name: N-(phenylmethyl)-2-[4-(5,6,7,8-tetrahydronaphthalen-2-ylcarbonyl)piperazin-1-ium-1-yl]ethanamide Openeye Name: N-benzyl-2-[4-(tetralin-6-carbonyl)piperazin-1-ium-1-yl]acetamide CAS Name: 2-[4-[oxo(5,6,7,8-tetrahydronaphthalen-2-yl)methyl]-1-piperazin-1-iumyl]-N-(phenylmethyl)acetamide IUPAC Name: N-benzyl-2-[4-(5,6,7,8-tetrahydronaphthalene-2-carbonyl)piperazin-1-ium-1-yl]acetamide Traditional Name: N-benzyl-2-[4-(tetralin-6-carbonyl)piperazin-1-ium-1-yl]acetamide Formula: C24H30N3O2+ MolecularWeight: 392.5139

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C=CC(=C2)C(=O)N3CC[NH+](CC3)CC(=O)NCC4=CC=CC=C4

Isomeric SMILES

C1CCC2=C(C1)C=CC(=C2)C(=O)N3CC[NH+](CC3)CC(=O)NCC4=CC=CC=C4

InChI

InChI=1S/C24H29N3O2/c28-23(25-17-19-6-2-1-3-7-19)18-26-12-14-27(15-13-26)24(29)22-11-10-20-8-4-5-9-21(20)16-22/h1-3,6-7,10-11,16H,4-5,8-9,12-15,17-18H2,(H,25,28)/p+1