(phenylmethyl) N-[3-[(4-aminophenyl)sulfonyl-(2-methylpropyl)amino]-2-phosphonooxy-propyl]carbamate

Systemtic Name: (phenylmethyl) N-[3-[(4-aminophenyl)sulfonyl-(2-methylpropyl)amino]-2-phosphonooxy-propyl]carbamate Openeye Name: benzyl N-[3-[(4-aminophenyl)sulfonyl-isobutyl-amino]-2-phosphonooxy-propyl]carbamate CAS Name: N-[3-[(4-aminophenyl)sulfonyl-(2-methylpropyl)amino]-2-phosphonooxypropyl]carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-[3-[(4-aminophenyl)sulfonyl-(2-methylpropyl)amino]-2-phosphonooxypropyl]carbamate Traditional Name: N-[3-[isobutyl(sulfanilyl)amino]-2-phosphonooxy-propyl]carbamic acid benzyl ester Formula: C21H30N3O8PS MolecularWeight: 515.516961

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN(CC(CNC(=O)OCC1=CC=CC=C1)OP(=O)(O)O)S(=O)(=O)C2=CC=C(C=C2)N

Isomeric SMILES

CC(C)CN(CC(CNC(=O)OCC1=CC=CC=C1)OP(=O)(O)O)S(=O)(=O)C2=CC=C(C=C2)N

InChI

InChI=1S/C21H30N3O8PS/c1-16(2)13-24(34(29,30)20-10-8-18(22)9-11-20)14-19(32-33(26,27)28)12-23-21(25)31-15-17-6-4-3-5-7-17/h3-11,16,19H,12-15,22H2,1-2H3,(H,23,25)(H2,26,27,28)