N-[(S)-(3-methoxyphenyl)-(1-oxidanidyl-2-phenyl-indol-3-yl)methyl]pyridin-2-amine

Systemtic Name: N-[(S)-(3-methoxyphenyl)-(1-oxidanidyl-2-phenyl-indol-3-yl)methyl]pyridin-2-amine Openeye Name: N-[(S)-(3-methoxyphenyl)-(1-oxido-2-phenyl-indol-3-yl)methyl]pyridin-2-amine CAS Name: N-[(S)-(3-methoxyphenyl)-(1-oxido-2-phenyl-3-indolyl)methyl]-2-pyridinamine IUPAC Name: N-[(S)-(3-methoxyphenyl)-(1-oxido-2-phenylindol-3-yl)methyl]pyridin-2-amine Traditional Name: [(S)-(3-methoxyphenyl)-(1-oxido-2-phenyl-indol-3-yl)methyl]-(2-pyridyl)amine Formula: C27H22N3O2- MolecularWeight: 420.48248

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C(C2=C(N(C3=CC=CC=C32)[O-])C4=CC=CC=C4)NC5=CC=CC=N5

Isomeric SMILES

COC1=CC=CC(=C1)[C@@H](C2=C(N(C3=CC=CC=C32)[O-])C4=CC=CC=C4)NC5=CC=CC=N5

InChI

InChI=1S/C27H22N3O2/c1-32-21-13-9-12-20(18-21)26(29-24-16-7-8-17-28-24)25-22-14-5-6-15-23(22)30(31)27(25)19-10-3-2-4-11-19/h2-18,26H,1H3,(H,28,29)/q-1/t26-/m0/s1