[4-[bis[2-(dibutylamino)-2-oxidanylidene-ethyl]amino]-2-pentan-3-yloxy-phenyl]iminoazanium

Systemtic Name: [4-[bis[2-(dibutylamino)-2-oxidanylidene-ethyl]amino]-2-pentan-3-yloxy-phenyl]iminoazanium Openeye Name: [4-[bis[2-(dibutylamino)-2-oxo-ethyl]amino]-2-(1-ethylpropoxy)phenyl]iminoammonium CAS Name: [4-[bis[2-(dibutylamino)-2-oxoethyl]amino]-2-pentan-3-yloxyphenyl]iminoammonium IUPAC Name: [4-[bis[2-(dibutylamino)-2-oxoethyl]amino]-2-pentan-3-yloxyphenyl]iminoazanium Traditional Name: [4-[bis[2-(dibutylamino)-2-keto-ethyl]amino]-2-(1-ethylpropoxy)phenyl]iminoammonium Formula: C31H56N5O3+ MolecularWeight: 546.80804

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CCCC)C(=O)CN(CC(=O)N(CCCC)CCCC)C1=CC(=C(C=C1)N=[NH2+])OC(CC)CC

Isomeric SMILES

CCCCN(CCCC)C(=O)CN(CC(=O)N(CCCC)CCCC)C1=CC(=C(C=C1)N=[NH2+])OC(CC)CC

InChI

InChI=1S/C31H55N5O3/c1-7-13-19-34(20-14-8-2)30(37)24-36(25-31(38)35(21-15-9-3)22-16-10-4)26-17-18-28(33-32)29(23-26)39-27(11-5)12-6/h17-18,23,27,32H,7-16,19-22,24-25H2,1-6H3/p+1