2-dimethylaminoethyl-[1-[[(E)-hexadec-4-enyl]-(3-propyltetradecanoyl)amino]-3-oxidanyl-propan-2-yl]-oxidanylidene-phosphanium

Systemtic Name: 2-dimethylaminoethyl-[1-[[(E)-hexadec-4-enyl]-(3-propyltetradecanoyl)amino]-3-oxidanyl-propan-2-yl]-oxidanylidene-phosphanium Openeye Name: 2-dimethylaminoethyl-[1-[[[(E)-hexadec-4-enyl]-(3-propyltetradecanoyl)amino]methyl]-2-hydroxy-ethyl]-oxo-phosphonium CAS Name: 2-dimethylaminoethyl-[1-[[(E)-hexadec-4-enyl]-(1-oxo-3-propyltetradecyl)amino]-3-hydroxypropan-2-yl]-oxophosphonium IUPAC Name: 2-dimethylaminoethyl-[1-[[(E)-hexadec-4-enyl]-(3-propyltetradecanoyl)amino]-3-hydroxypropan-2-yl]-oxophosphanium Traditional Name: 2-dimethylaminoethyl-[1-[[[(E)-hexadec-4-enyl]-(3-propyltetradecanoyl)amino]methyl]-2-hydroxy-ethyl]-keto-phosphonium Formula: C40H80N2O3P+ MolecularWeight: 668.048561

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC=CCCCN(CC(CO)[P+](=O)CCN(C)C)C(=O)CC(CCC)CCCCCCCCCCC

Isomeric SMILES

CCCCCCCCCCC/C=C/CCCN(CC(CO)[P+](=O)CCN(C)C)C(=O)CC(CCC)CCCCCCCCCCC

InChI

InChI=1S/C40H80N2O3P/c1-6-9-11-13-15-17-18-19-20-21-23-25-27-29-32-42(36-39(37-43)46(45)34-33-41(4)5)40(44)35-38(30-8-3)31-28-26-24-22-16-14-12-10-7-2/h23,25,38-39,43H,6-22,24,26-37H2,1-5H3/q+1/b25-23+