3-[4-(4-bromanylnaphthalen-1-yl)piperazin-1-yl]propyl N-(1,3-benzodioxol-5-yl)carbamate

Systemtic Name: 3-[4-(4-bromanylnaphthalen-1-yl)piperazin-1-yl]propyl N-(1,3-benzodioxol-5-yl)carbamate Openeye Name: 3-[4-(4-bromo-1-naphthyl)piperazin-1-yl]propyl N-(1,3-benzodioxol-5-yl)carbamate CAS Name: N-(1,3-benzodioxol-5-yl)carbamic acid 3-[4-(4-bromo-1-naphthalenyl)-1-piperazinyl]propyl ester IUPAC Name: 3-[4-(4-bromonaphthalen-1-yl)piperazin-1-yl]propyl N-(1,3-benzodioxol-5-yl)carbamate Traditional Name: N-(1,3-benzodioxol-5-yl)carbamic acid 3-[4-(4-bromo-1-naphthyl)piperazino]propyl ester Formula: C25H26BrN3O4 MolecularWeight: 512.39564

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCCOC(=O)NC2=CC3=C(C=C2)OCO3)C4=CC=C(C5=CC=CC=C54)Br

Isomeric SMILES

C1CN(CCN1CCCOC(=O)NC2=CC3=C(C=C2)OCO3)C4=CC=C(C5=CC=CC=C54)Br

InChI

InChI=1S/C25H26BrN3O4/c26-21-7-8-22(20-5-2-1-4-19(20)21)29-13-11-28(12-14-29)10-3-15-31-25(30)27-18-6-9-23-24(16-18)33-17-32-23/h1-2,4-9,16H,3,10-15,17H2,(H,27,30)