[4-[bis[3-(C,N-dibutylcarbonimidoyl)oxypropyl]amino]-2-methyl-phenyl]iminoazanium

Systemtic Name: [4-[bis[3-(C,N-dibutylcarbonimidoyl)oxypropyl]amino]-2-methyl-phenyl]iminoazanium Openeye Name: [4-[bis[3-(C,N-dibutylcarbonimidoyl)oxypropyl]amino]-2-methyl-phenyl]iminoammonium CAS Name: [4-[bis[3-(1-butyliminopentoxy)propyl]amino]-2-methylphenyl]iminoammonium IUPAC Name: [4-[bis[3-(C,N-dibutylcarbonimidoyl)oxypropyl]amino]-2-methylphenyl]iminoazanium Traditional Name: [4-[bis[3-(C,N-dibutylcarbonimidoyl)oxypropyl]amino]-2-methyl-phenyl]iminoammonium Formula: C31H56N5O2+ MolecularWeight: 530.80864

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=NCCCC)OCCCN(CCCOC(=NCCCC)CCCC)C1=CC(=C(C=C1)N=[NH2+])C

Isomeric SMILES

CCCCC(=NCCCC)OCCCN(CCCOC(=NCCCC)CCCC)C1=CC(=C(C=C1)N=[NH2+])C

InChI

InChI=1S/C31H55N5O2/c1-6-10-16-30(33-20-12-8-3)37-24-14-22-36(28-18-19-29(35-32)27(5)26-28)23-15-25-38-31(17-11-7-2)34-21-13-9-4/h18-19,26,32H,6-17,20-25H2,1-5H3/p+1