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2-[5-[azaniumylidene(azanyl)methyl]-2H-indol-1-ium-2-yl]-6-cyclopentyloxy-phenolate

2-[5-[azaniumylidene(azanyl)methyl]-2H-indol-1-ium-2-yl]-6-cyclopentyloxy-phenolate

Systemtic Name:2-[5-[azaniumylidene(azanyl)methyl]-2H-indol-1-ium-2-yl]-6-cyclopentyloxy-phenolate
Openeye Name:2-[5-[amino(azaniumylidene)methyl]-2H-indol-1-ium-2-yl]-6-(cyclopentoxy)phenolate
CAS Name:2-[5-[amino(iminio)methyl]-2H-indol-1-ium-2-yl]-6-cyclopentyloxyphenolate
IUPAC Name:2-[5-[amino(azaniumylidene)methyl]-2H-indol-1-ium-2-yl]-6-cyclopentyloxyphenolate
Traditional Name:2-[5-[amino(iminio)methyl]-2H-indol-1-ium-2-yl]-6-(cyclopentoxy)phenolate
Formula: C20H22N3O2+
MolecularWeight: 336.40758
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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)OC2=CC=CC(=C2[O-])C3C=C4C=C(C=CC4=[NH+]3)C(=[NH2+])N


Isomeric SMILES

C1CCC(C1)OC2=CC=CC(=C2[O-])C3C=C4C=C(C=CC4=[NH+]3)C(=[NH2+])N


InChI

InChI=1S/C20H21N3O2/c21-20(22)12-8-9-16-13(10-12)11-17(23-16)15-6-3-7-18(19(15)24)25-14-4-1-2-5-14/h3,6-11,14,17,24H,1-2,4-5H2,(H3,21,22)/p+1


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