1-[(1R)-1-[1-(2-methoxyethyl)-5-methyl-4-phenyl-pyrrol-2-yl]pentyl]benzotriazole

Systemtic Name: 1-[(1R)-1-[1-(2-methoxyethyl)-5-methyl-4-phenyl-pyrrol-2-yl]pentyl]benzotriazole Openeye Name: 1-[(1R)-1-[1-(2-methoxyethyl)-5-methyl-4-phenyl-pyrrol-2-yl]pentyl]benzotriazole CAS Name: 1-[(1R)-1-[1-(2-methoxyethyl)-5-methyl-4-phenyl-2-pyrrolyl]pentyl]benzotriazole IUPAC Name: 1-[(1R)-1-[1-(2-methoxyethyl)-5-methyl-4-phenylpyrrol-2-yl]pentyl]benzotriazole Traditional Name: 1-[(1R)-1-[1-(2-methoxyethyl)-5-methyl-4-phenyl-pyrrol-2-yl]pentyl]benzotriazole Formula: C25H30N4O MolecularWeight: 402.5319

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C1=CC(=C(N1CCOC)C)C2=CC=CC=C2)N3C4=CC=CC=C4N=N3

Isomeric SMILES

CCCC[C@H](C1=CC(=C(N1CCOC)C)C2=CC=CC=C2)N3C4=CC=CC=C4N=N3

InChI

InChI=1S/C25H30N4O/c1-4-5-14-24(29-23-15-10-9-13-22(23)26-27-29)25-18-21(20-11-7-6-8-12-20)19(2)28(25)16-17-30-3/h6-13,15,18,24H,4-5,14,16-17H2,1-3H3/t24-/m1/s1