4-[(2,2-dimethyl-3H-1-benzofuran-7-yl)-(4-phosphanylpiperazin-1-yl)methyl]-N,N-diethyl-benzamide

Systemtic Name: 4-[(2,2-dimethyl-3H-1-benzofuran-7-yl)-(4-phosphanylpiperazin-1-yl)methyl]-N,N-diethyl-benzamide Openeye Name: 4-[(2,2-dimethyl-3H-benzofuran-7-yl)-(4-phosphanylpiperazin-1-yl)methyl]-N,N-diethyl-benzamide CAS Name: 4-[(2,2-dimethyl-3H-benzofuran-7-yl)-(4-phosphino-1-piperazinyl)methyl]-N,N-diethylbenzamide IUPAC Name: 4-[(2,2-dimethyl-3H-1-benzofuran-7-yl)-(4-phosphanylpiperazin-1-yl)methyl]-N,N-diethylbenzamide Traditional Name: 4-[(2,2-dimethylcoumaran-7-yl)-(4-phosphinopiperazino)methyl]-N,N-diethyl-benzamide Formula: C26H36N3O2P MolecularWeight: 453.556701

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)C1=CC=C(C=C1)C(C2=CC=CC3=C2OC(C3)(C)C)N4CCN(CC4)P

Isomeric SMILES

CCN(CC)C(=O)C1=CC=C(C=C1)C(C2=CC=CC3=C2OC(C3)(C)C)N4CCN(CC4)P

InChI

InChI=1S/C26H36N3O2P/c1-5-27(6-2)25(30)20-12-10-19(11-13-20)23(28-14-16-29(32)17-15-28)22-9-7-8-21-18-26(3,4)31-24(21)22/h7-13,23H,5-6,14-18,32H2,1-4H3