[4-azanyl-2-[bis[(cyclohexylamino)methyl]amino]-3-(3-naphthalen-2-ylpropanoyl)phenyl]methyl-tributyl-phosphanium

Systemtic Name: [4-azanyl-2-[bis[(cyclohexylamino)methyl]amino]-3-(3-naphthalen-2-ylpropanoyl)phenyl]methyl-tributyl-phosphanium Openeye Name: [4-amino-2-[bis[(cyclohexylamino)methyl]amino]-3-[3-(2-naphthyl)propanoyl]phenyl]methyl-tributyl-phosphonium CAS Name: [4-amino-2-[bis[(cyclohexylamino)methyl]amino]-3-[3-(2-naphthalenyl)-1-oxopropyl]phenyl]methyl-tributylphosphonium IUPAC Name: [4-amino-2-[bis[(cyclohexylamino)methyl]amino]-3-(3-naphthalen-2-ylpropanoyl)phenyl]methyl-tributylphosphanium Traditional Name: [4-amino-2-[bis[(cyclohexylamino)methyl]amino]-3-[3-(2-naphthyl)propanoyl]benzyl]-tributyl-phosphonium Formula: C46H72N4OP+ MolecularWeight: 728.063841

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Descriptors Computed from Structure

Canonical SMILES:

CCCC[P+](CCCC)(CCCC)CC1=C(C(=C(C=C1)N)C(=O)CCC2=CC3=CC=CC=C3C=C2)N(CNC4CCCCC4)CNC5CCCCC5

Isomeric SMILES

CCCC[P+](CCCC)(CCCC)CC1=C(C(=C(C=C1)N)C(=O)CCC2=CC3=CC=CC=C3C=C2)N(CNC4CCCCC4)CNC5CCCCC5

InChI

InChI=1S/C46H71N4OP/c1-4-7-30-52(31-8-5-2,32-9-6-3)34-40-27-28-43(47)45(44(51)29-25-37-24-26-38-18-16-17-19-39(38)33-37)46(40)50(35-48-41-20-12-10-13-21-41)36-49-42-22-14-11-15-23-42/h16-19,24,26-28,33,41-42,48-49H,4-15,20-23,25,29-32,34-36H2,1-3H3,(H-,47,51)/p+1