tert-butyl N-[3-[4-(naphthalen-1-ylmethyl)piperazin-4-ium-1-yl]-3-oxidanylidene-propyl]carbamate

Systemtic Name: tert-butyl N-[3-[4-(naphthalen-1-ylmethyl)piperazin-4-ium-1-yl]-3-oxidanylidene-propyl]carbamate Openeye Name: tert-butyl N-[3-[4-(1-naphthylmethyl)piperazin-4-ium-1-yl]-3-oxo-propyl]carbamate CAS Name: N-[3-[4-(1-naphthalenylmethyl)-1-piperazin-4-iumyl]-3-oxopropyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[3-[4-(naphthalen-1-ylmethyl)piperazin-4-ium-1-yl]-3-oxopropyl]carbamate Traditional Name: N-[3-keto-3-[4-(1-naphthylmethyl)piperazin-4-ium-1-yl]propyl]carbamic acid tert-butyl ester Formula: C23H32N3O3+ MolecularWeight: 398.51848

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NCCC(=O)N1CC[NH+](CC1)CC2=CC=CC3=CC=CC=C32

Isomeric SMILES

CC(C)(C)OC(=O)NCCC(=O)N1CC[NH+](CC1)CC2=CC=CC3=CC=CC=C32

InChI

InChI=1S/C23H31N3O3/c1-23(2,3)29-22(28)24-12-11-21(27)26-15-13-25(14-16-26)17-19-9-6-8-18-7-4-5-10-20(18)19/h4-10H,11-17H2,1-3H3,(H,24,28)/p+1