4-[2-(5-chloranyl-2-methoxy-phenyl)-5-phenylmethoxy-1H-indol-3-yl]butan-1-amine

Systemtic Name: 4-[2-(5-chloranyl-2-methoxy-phenyl)-5-phenylmethoxy-1H-indol-3-yl]butan-1-amine Openeye Name: 4-[5-benzyloxy-2-(5-chloro-2-methoxy-phenyl)-1H-indol-3-yl]butan-1-amine CAS Name: 4-[2-(5-chloro-2-methoxyphenyl)-5-phenylmethoxy-1H-indol-3-yl]-1-butanamine IUPAC Name: 4-[2-(5-chloro-2-methoxyphenyl)-5-phenylmethoxy-1H-indol-3-yl]butan-1-amine Traditional Name: 4-[5-benzoxy-2-(5-chloro-2-methoxy-phenyl)-1H-indol-3-yl]butylamine Formula: C26H27ClN2O2 MolecularWeight: 434.95778

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Cl)C2=C(C3=C(N2)C=CC(=C3)OCC4=CC=CC=C4)CCCCN

Isomeric SMILES

COC1=C(C=C(C=C1)Cl)C2=C(C3=C(N2)C=CC(=C3)OCC4=CC=CC=C4)CCCCN

InChI

InChI=1S/C26H27ClN2O2/c1-30-25-13-10-19(27)15-23(25)26-21(9-5-6-14-28)22-16-20(11-12-24(22)29-26)31-17-18-7-3-2-4-8-18/h2-4,7-8,10-13,15-16,29H,5-6,9,14,17,28H2,1H3