[(3,5-ditert-butyl-4-methoxy-phenyl)-(3-phenylpropylamino)methyl]phosphonic acid

Systemtic Name: [(3,5-ditert-butyl-4-methoxy-phenyl)-(3-phenylpropylamino)methyl]phosphonic acid Openeye Name: [(3,5-ditert-butyl-4-methoxy-phenyl)-(3-phenylpropylamino)methyl]phosphonic acid CAS Name: [(3,5-ditert-butyl-4-methoxyphenyl)-(3-phenylpropylamino)methyl]phosphonic acid IUPAC Name: [(3,5-ditert-butyl-4-methoxyphenyl)-(3-phenylpropylamino)methyl]phosphonic acid Traditional Name: [(3,5-ditert-butyl-4-methoxy-phenyl)-(3-phenylpropylamino)methyl]phosphonic acid Formula: C25H38NO4P MolecularWeight: 447.547281

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=CC(=C1OC)C(C)(C)C)C(NCCCC2=CC=CC=C2)P(=O)(O)O

Isomeric SMILES

CC(C)(C)C1=CC(=CC(=C1OC)C(C)(C)C)C(NCCCC2=CC=CC=C2)P(=O)(O)O

InChI

InChI=1S/C25H38NO4P/c1-24(2,3)20-16-19(17-21(22(20)30-7)25(4,5)6)23(31(27,28)29)26-15-11-14-18-12-9-8-10-13-18/h8-10,12-13,16-17,23,26H,11,14-15H2,1-7H3,(H2,27,28,29)