methyl N-[4-[3-[3-(benzimidazol-1-yl)propylamino]-2-oxidanyl-propoxy]phenyl]carbamate

Systemtic Name: methyl N-[4-[3-[3-(benzimidazol-1-yl)propylamino]-2-oxidanyl-propoxy]phenyl]carbamate Openeye Name: methyl N-[4-[3-[3-(benzimidazol-1-yl)propylamino]-2-hydroxy-propoxy]phenyl]carbamate CAS Name: N-[4-[3-[3-(1-benzimidazolyl)propylamino]-2-hydroxypropoxy]phenyl]carbamic acid methyl ester IUPAC Name: methyl N-[4-[3-[3-(benzimidazol-1-yl)propylamino]-2-hydroxypropoxy]phenyl]carbamate Traditional Name: N-[4-[3-[3-(benzimidazol-1-yl)propylamino]-2-hydroxy-propoxy]phenyl]carbamic acid methyl ester Formula: C21H26N4O4 MolecularWeight: 398.45554

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)NC1=CC=C(C=C1)OCC(CNCCCN2C=NC3=CC=CC=C32)O

Isomeric SMILES

COC(=O)NC1=CC=C(C=C1)OCC(CNCCCN2C=NC3=CC=CC=C32)O

InChI

InChI=1S/C21H26N4O4/c1-28-21(27)24-16-7-9-18(10-8-16)29-14-17(26)13-22-11-4-12-25-15-23-19-5-2-3-6-20(19)25/h2-3,5-10,15,17,22,26H,4,11-14H2,1H3,(H,24,27)