N,N-bis(2-chloroethyl)-2-oxidanylidene-1,3,2$l^{5}-oxazaphosphinan-2-amine; 2-methyl-2-[[1-(phenylmethyl)indazol-3-yl]methoxy]propanoic acid; hydrate

Systemtic Name: N,N-bis(2-chloroethyl)-2-oxidanylidene-1,3,2$l^{5}-oxazaphosphinan-2-amine; 2-methyl-2-[[1-(phenylmethyl)indazol-3-yl]methoxy]propanoic acid; hydrate Openeye Name: 2-[(1-benzylindazol-3-yl)methoxy]-2-methyl-propanoic acid; N,N-bis(2-chloroethyl)-2-oxo-1,3,2$l^{5}-oxazaphosphinan-2-amine; hydrate CAS Name: N,N-bis(2-chloroethyl)-2-oxo-1,3,2$l^{5}-oxazaphosphorinan-2-amine; 2-methyl-2-[[1-(phenylmethyl)-3-indazolyl]methoxy]propanoic acid; hydrate IUPAC Name: 2-[(1-benzylindazol-3-yl)methoxy]-2-methylpropanoic acid; N,N-bis(2-chloroethyl)-2-oxo-1,3,2$l^{5}-oxazaphosphinan-2-amine; hydrate Traditional Name: 2-[(1-benzylindazol-3-yl)methoxy]-2-methyl-propionic acid; bis(2-chloroethyl)-(2-keto-1,3,2$l^{5}-oxazaphosphorinan-2-yl)amine; hydrate Formula: C26H37Cl2N4O6P MolecularWeight: 603.474941

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C(=O)O)OCC1=NN(C2=CC=CC=C21)CC3=CC=CC=C3.C1CNP(=O)(OC1)N(CCCl)CCCl.O

Isomeric SMILES

CC(C)(C(=O)O)OCC1=NN(C2=CC=CC=C21)CC3=CC=CC=C3.C1CNP(=O)(OC1)N(CCCl)CCCl.O

InChI

InChI=1S/C19H20N2O3.C7H15Cl2N2O2P.H2O/c1-19(2,18(22)23)24-13-16-15-10-6-7-11-17(15)21(20-16)12-14-8-4-3-5-9-14;8-2-5-11(6-3-9)14(12)10-4-1-7-13-14;/h3-11H,12-13H2,1-2H3,(H,22,23);1-7H2,(H,10,12);1H2